data_2n32_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 2n32 _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 ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.811 0.338 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.1 t -80.52 133.4 29.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -103.23 111.9 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -89.61 149.74 22.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -62.62 -34.97 78.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.845 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 65.27 138.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.89 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.69 25.47 9.17 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.479 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.29 -175.91 4.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.363 . . . . 0.0 110.847 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -165.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.2 p -75.67 116.75 16.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -171.54 153.46 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -174.9 158.1 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.886 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 84.8 mt -120.27 127.97 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -131.18 130.68 43.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t0 63.74 35.64 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.838 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 63.89 30.4 14.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.872 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -134.28 133.87 41.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -64.97 144.16 57.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.876 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -154.33 157.22 38.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -149.24 163.5 37.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.904 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.7 t -88.77 127.33 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.164 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.1 p -97.78 165.19 12.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.14 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -73.04 -17.41 61.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.853 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.72 126.61 28.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.857 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -110.24 140.39 44.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.13 134.4 21.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.59 0.709 . . . . 0.0 111.146 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 147.4 62.32 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.644 2.23 . . . . 0.0 112.388 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -54.89 -31.62 60.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.923 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -62.67 -21.95 66.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -93.41 -20.44 20.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -70.56 135.78 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.143 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -85.41 -57.34 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.67 178.33 3.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.0 p -55.76 161.22 2.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -131.85 -51.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.913 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.5 t -150.57 141.97 16.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.079 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -106.66 114.45 28.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -148.68 156.89 43.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -125.65 107.97 11.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -142.2 126.0 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.869 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 tt -138.08 138.98 39.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -152.18 169.39 22.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 21.4 mt -122.82 135.79 61.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.085 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -129.52 137.5 56.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.094 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -86.12 123.26 31.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.4 mtp -69.17 -9.95 55.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.06 -54.2 28.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.955 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -122.15 10.03 9.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 55.94 35.94 26.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -111.48 158.2 19.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.14 152.25 36.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.896 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 64.4 mt -129.84 -172.63 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.943 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -114.48 -16.13 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 p -134.78 176.85 8.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.2 t -107.57 108.55 19.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.8 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -107.8 173.43 6.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -67.87 -29.18 68.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-20 -91.48 13.25 18.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.4 t -130.98 158.32 40.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.6 t -133.58 135.76 55.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.5 t -77.96 140.45 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.114 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.4 mt -131.91 131.09 42.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 14.4 t -112.83 103.96 16.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.142 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.67 96.58 9.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.434 ' N ' HD21 ' A' ' 72' ' ' ASN . 0.1 OUTLIER -175.94 -168.9 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.868 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 68.01 0.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.3 mt -81.24 141.24 15.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.75 168.83 18.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -106.49 163.56 12.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.59 168.01 11.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.099 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -68.26 -27.61 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -95.61 26.6 3.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.888 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt 64.22 15.52 9.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.8 m -82.59 146.46 29.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.834 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.5 149.64 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.7 p -151.14 162.72 40.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.4 ttm -126.14 150.06 48.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.822 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -87.29 128.24 8.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.507 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.7 mt -146.2 111.86 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.811 0.338 . . . . 0.0 111.115 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 59.17 47.52 11.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 63.7 16.25 9.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -127.44 124.15 37.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -85.72 117.54 24.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -109.14 130.7 55.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.34 48.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.905 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.7 pt -118.24 133.5 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.105 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.16 159.46 64.94 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.622 0.725 . . . . 0.0 110.947 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 148.87 65.99 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 0.0 112.361 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -59.93 -20.14 55.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 49.5 m -69.23 -17.28 63.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -0.43 41.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -51.17 165.97 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 96.93 -41.47 2.34 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.5 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.41 -21.31 11.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.865 0.364 . . . . 0.0 111.116 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.13 146.68 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.163 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -129.45 166.33 19.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.947 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.48 168.02 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.095 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.52 164.89 20.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 21.4 mtt85 -111.93 139.41 47.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.65 -14.83 62.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.921 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -62.22 -17.06 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -78.78 -2.95 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . 0.997 ' C ' ' O ' ' A' ' 110' ' ' PHE . 22.5 m-85 . . . . . 1 C--O 2.0 40.583 1 CA-C-O 161.141 19.543 . . . . 0.0 110.877 179.99 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 tttt . . . . . 0 C--O 1.24 0.579 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 t -129.61 140.15 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 105.785 -1.932 . . . . 0.0 105.785 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -103.3 118.26 36.36 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.22 146.08 24.59 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -62.35 -34.87 77.51 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 64.28 133.59 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.702 2.001 . . . . 0.0 111.846 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.51 19.59 58.05 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.073 -1.017 . . . . 0.0 112.1 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.11 178.07 7.35 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.855 2.062 . . . . 0.0 109.983 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -169.56 0.78 Allowed 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.372 2.269 . . . . 0.0 107.771 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.2 p -79.96 120.74 24.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.378 -1.451 . . . . 0.0 107.743 -176.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -167.66 138.85 2.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.399 3.08 . . . . 0.0 106.117 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.401 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 35.9 p90 -162.15 177.94 9.23 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 123.561 0.744 . . . . 0.0 109.749 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 mt -137.93 122.92 23.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 C-N-CA 123.624 0.77 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 71.6 t80 -131.65 142.94 49.97 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.407 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 23.4 t70 56.32 34.31 23.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.809 1.244 . . . . 0.0 108.852 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 m120 62.35 12.05 4.98 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.254 2.222 . . . . 0.0 112.289 -178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.36 146.47 39.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 119.223 0.92 . . . . 0.0 109.235 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.1 m -75.38 133.48 41.18 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.302 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.401 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.6 m-85 -141.84 162.09 36.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.611 1.565 . . . . 0.0 109.123 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -148.56 161.73 41.08 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 121.031 -1.043 . . . . 0.0 108.619 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.79 130.76 40.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -100.19 169.83 8.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.128 0.971 . . . . 0.0 111.385 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.76 -14.63 61.15 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 126.935 2.094 . . . . 0.0 111.797 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -69.91 124.36 23.83 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 124.801 1.24 . . . . 0.0 109.693 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.32 144.74 40.02 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -123.74 138.7 30.85 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.384 1.474 . . . . 0.0 107.807 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.33 153.51 50.72 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.392 2.061 . . . . 0.0 112.646 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -50.39 -33.84 22.1 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 126.298 1.839 . . . . 0.0 114.45 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.484 ' HG3' HD21 ' A' ' 37' ' ' ASN . 5.8 pt-20 -67.82 -27.56 66.83 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.344 0.658 . . . . 0.0 111.625 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.484 HD21 ' HG3' ' A' ' 36' ' ' GLU . 1.9 m-80 -82.45 -24.76 34.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -67.13 119.51 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -74.21 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.58 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.62 172.37 15.48 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.06 0.544 . . . . 0.0 111.2 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.1 t -60.74 157.86 13.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.411 1.484 . . . . 0.0 108.722 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.503 ' HE2' ' CD1' ' A' ' 82' ' ' LEU . 3.7 tttp -133.43 -51.22 0.87 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 117.498 -1.239 . . . . 0.0 111.299 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -144.28 112.05 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.258 0.936 . . . . 0.0 111.408 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -84.41 92.62 8.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.41 156.65 38.5 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 130.019 3.328 . . . . 0.0 105.981 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -135.93 121.63 19.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.714 1.605 . . . . 0.0 110.145 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -147.45 132.77 18.5 Favored 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tt -134.45 143.23 47.41 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 126.924 2.09 . . . . 0.0 106.249 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -157.61 167.56 29.79 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.747 1.619 . . . . 0.0 107.695 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.5 mt -126.62 127.42 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.0 t -112.48 139.85 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.069 1.347 . . . . 0.0 109.584 -179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -87.01 120.86 28.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.153 1.381 . . . . 0.0 108.507 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.6 mtp -64.72 -21.07 66.67 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -77.01 -53.49 7.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 120.967 1.712 . . . . 0.0 111.937 -179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.5 m -96.9 -6.51 35.58 Favored 'General case' 0 CA--C 1.523 -0.072 0 CA-C-O 118.097 -0.954 . . . . 0.0 113.394 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 65.15 21.9 12.2 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -101.22 157.43 16.78 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 124.823 1.249 . . . . 0.0 111.088 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.82 152.83 33.26 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.0 mt -127.21 169.09 13.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.128 0.971 . . . . 0.0 109.814 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.2 p -109.99 11.56 23.96 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 126.988 2.115 . . . . 0.0 108.991 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.3 p -155.0 169.23 24.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.045 1.338 . . . . 0.0 111.714 -179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.8 t -101.62 110.84 22.91 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -117.64 157.2 26.85 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.573 0.749 . . . . 0.0 109.206 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -32.25 69.94 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.628 1.558 . . . . 0.0 113.704 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -85.02 15.43 4.07 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.353 1.061 . . . . 0.0 109.896 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 p -120.88 162.85 19.12 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.676 1.19 . . . . 0.0 110.55 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.5 t -137.77 130.63 41.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.3 t -80.25 134.09 36.06 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 106.039 -1.838 . . . . 0.0 106.039 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.3 125.51 43.63 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 t -104.69 103.01 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 102.879 -3.008 . . . . 0.0 102.879 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -96.34 91.86 6.05 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -168.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -175.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 48.07 67.17 0.88 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.825 1.25 . . . . 0.0 111.598 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -72.02 144.9 12.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.932 1.293 . . . . 0.0 111.697 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -138.25 169.25 18.12 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.295 2.238 . . . . 0.0 110.403 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -117.15 162.71 17.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.123 2.169 . . . . 0.0 108.139 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.15 175.41 6.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.396 1.878 . . . . 0.0 111.358 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -53.27 -48.04 68.63 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.03 1.732 . . . . 0.0 111.754 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -85.48 18.86 2.56 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.083 -1.01 . . . . 0.0 111.936 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.11 8.91 5.98 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.534 1.933 . . . . 0.0 109.723 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -64.52 157.03 27.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.503 ' CD1' ' HE2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -116.17 155.28 28.54 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.334 -0.854 . . . . 0.0 111.361 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.9 p -151.54 168.89 23.51 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.6 ttm -135.98 143.65 44.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.724 1.609 . . . . 0.0 109.737 -178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.73 125.37 7.03 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 109.796 -1.321 . . . . 0.0 109.796 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mt -143.38 121.73 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 50.84 35.72 12.92 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.574 0.75 . . . . 0.0 111.084 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 74.63 12.51 3.75 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 126.17 1.788 . . . . 0.0 114.31 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -120.04 135.64 54.86 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.639 1.175 . . . . 0.0 109.006 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -88.86 115.83 26.7 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.476 0.711 . . . . 0.0 110.591 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -109.18 131.54 54.97 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.517 1.127 . . . . 0.0 111.247 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -65.77 148.74 51.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.977 0.911 . . . . 0.0 110.31 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.3 pt -117.65 133.04 65.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -121.61 159.72 49.45 Favored Pre-proline 0 N--CA 1.467 0.405 0 C-N-CA 125.575 1.55 . . . . 0.0 109.21 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -71.98 151.36 56.13 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.07 1.847 . . . . 0.0 109.022 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.01 -5.68 5.01 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 p -80.16 -23.68 40.9 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.133 1.373 . . . . 0.0 111.181 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -72.31 -0.26 11.8 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.305 1.842 . . . . 0.0 114.539 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.1 mmtt -51.85 157.09 1.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.976 1.311 . . . . 0.0 111.272 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.1 -26.37 17.41 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.465 1.031 . . . . 0.0 111.483 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.03 -12.44 11.97 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.15 1.38 . . . . 0.0 110.149 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.8 p -150.26 150.27 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 C-N-CA 124.743 1.217 . . . . 0.0 108.127 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -129.82 173.0 11.08 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.895 2.478 . . . . 0.0 105.336 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 166.35 5.38 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.867 0.841 . . . . 0.0 111.043 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.58 162.48 8.25 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.012 0.925 . . . . 0.0 110.162 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.5 138.82 47.52 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.445 0.698 . . . . 0.0 112.169 -178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.61 -16.4 62.83 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.172 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -67.61 -3.82 10.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.637 1.175 . . . . 0.0 112.855 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -90.73 4.2 52.21 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 120.858 -1.152 . . . . 0.0 110.251 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 126.437 1.895 . . . . 0.0 107.994 -178.803 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 t -107.32 136.98 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.7 119.12 38.46 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 106.147 -1.798 . . . . 0.0 106.147 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -93.54 172.21 8.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.871 1.268 . . . . 0.0 110.125 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -65.02 -25.4 67.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 128.39 2.676 . . . . 0.0 114.695 178.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 45.12 92.96 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.919 2.087 . . . . 0.0 114.264 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 31.55 50.52 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 113.325 -1.761 . . . . 0.0 113.18 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -136.01 -178.96 5.38 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 127.392 2.277 . . . . 0.0 110.434 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.99 -170.99 0.8 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.873 1.269 . . . . 0.0 108.404 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -79.13 120.44 23.66 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.783 -1.823 . . . . 0.0 110.274 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -168.99 145.47 3.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.014 2.926 . . . . 0.0 107.421 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 45.4 p90 -165.15 166.42 19.03 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mp -123.16 121.87 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 120.886 -1.134 . . . . 0.0 108.715 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -131.82 140.31 49.11 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 55.23 36.69 27.56 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.29 1.036 . . . . 0.0 110.72 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 m120 59.49 18.91 7.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.886 1.674 . . . . 0.0 112.753 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.95 140.01 50.7 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 126.273 1.829 . . . . 0.0 106.148 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 m -80.0 140.51 36.56 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.5 m-85 -140.83 162.83 34.5 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.479 1.912 . . . . 0.0 110.72 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.44 ' CD1' ' HE2' ' A' ' 99' ' ' LYS . 47.6 p90 -149.46 159.78 44.01 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.9 1.28 . . . . 0.0 109.64 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.5 t -89.06 133.47 31.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -99.67 169.95 8.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.206 1.003 . . . . 0.0 111.454 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -71.95 -21.01 61.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.64 2.776 . . . . 0.0 112.751 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 126.45 30.75 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.336 1.454 . . . . 0.0 112.711 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -99.31 147.68 24.94 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.82 2.048 . . . . 0.0 109.418 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.2 mp -114.3 127.41 26.85 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.26 148.1 79.62 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 121.57 1.513 . . . . 0.0 110.666 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.74 -27.22 49.45 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -72.02 -19.79 61.8 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.441 0.696 . . . . 0.0 111.94 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -90.55 -21.66 21.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.72 -0.612 . . . . 0.0 110.102 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 82.5 t -59.49 137.26 22.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 124.905 1.282 . . . . 0.0 107.736 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.431 ' ND2' HD21 ' A' ' 40' ' ' ASN . 0.1 OUTLIER -91.12 -61.66 1.61 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 118.538 -0.744 . . . . 0.0 109.16 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.431 HD21 ' ND2' ' A' ' 39' ' ' ASN . 5.6 p30 -161.29 167.56 25.67 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.049 0.84 . . . . 0.0 112.057 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.9 m -69.4 133.79 48.22 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.769 1.228 . . . . 0.0 108.741 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -57.02 2.09 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 117.697 -1.145 . . . . 0.0 111.902 -178.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.1 t -141.0 121.99 13.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -84.98 117.6 24.06 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 105.025 -2.213 . . . . 0.0 105.025 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.19 159.74 43.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 128.584 2.754 . . . . 0.0 109.541 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -141.33 121.4 13.74 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.112 -0.992 . . . . 0.0 108.908 177.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -148.14 137.44 22.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -134.93 143.29 46.82 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.775 2.03 . . . . 0.0 108.211 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -155.69 170.0 23.04 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.439 1.496 . . . . 0.0 109.539 177.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 mt -129.46 129.76 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.452 ' C ' ' HG ' ' A' ' 66' ' ' SER . 25.3 t -128.36 134.04 65.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.473 1.109 . . . . 0.0 111.04 -178.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -71.13 117.52 12.75 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 128.12 2.568 . . . . 0.0 108.06 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.6 mtp -67.83 -23.27 65.15 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.833 1.197 . . . . 0.0 113.314 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -69.61 -53.37 19.15 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.972 0.805 . . . . 0.0 110.21 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.1 m -106.78 -2.93 20.98 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 117.07 2.248 . . . . 0.0 117.07 -177.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 59.05 35.08 23.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.823 1.249 . . . . 0.0 112.128 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -116.73 148.37 41.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.482 1.113 . . . . 0.0 109.289 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.7 155.05 40.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 79.1 mt -131.3 170.59 14.4 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 109.807 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.4 p -92.36 -27.48 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.669 1.187 . . . . 0.0 112.714 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.0 m -135.83 163.33 30.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.06 1.344 . . . . 0.0 110.392 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -88.11 109.74 20.11 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.453 1.501 . . . . 0.0 110.166 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -119.09 157.95 26.83 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -55.81 -18.75 9.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -92.04 7.8 40.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 119.538 1.063 . . . . 0.0 110.356 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.452 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 15.1 t -133.83 166.89 21.61 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.473 1.909 . . . . 0.0 111.041 -177.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -142.2 156.21 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.99 1.716 . . . . 0.0 107.878 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.2 t -105.69 143.9 33.19 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.27 1.428 . . . . 0.0 108.577 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.44 133.69 44.17 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.0 t -104.52 102.3 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 103.846 -2.65 . . . . 0.0 103.846 178.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -82.83 95.62 7.97 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.55 -173.42 3.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 47.27 68.77 0.59 Allowed 'General case' 0 C--N 1.342 0.248 0 C-N-CA 127.694 2.398 . . . . 0.0 112.705 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.5 mt -72.45 140.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -134.64 170.27 16.05 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 127.284 2.233 . . . . 0.0 109.218 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.65 152.62 34.82 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 126.077 1.751 . . . . 0.0 108.079 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.8 165.57 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.965 1.706 . . . . 0.0 109.216 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.2 t -61.56 -24.77 66.88 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.896 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -81.88 7.93 11.63 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.577 2.351 . . . . 0.0 110.042 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt 68.84 -0.8 2.24 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.32 2.248 . . . . 0.0 109.794 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.1 t -75.16 168.57 19.73 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -114.81 156.18 25.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.401 1.081 . . . . 0.0 111.853 -178.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.3 p -145.8 166.48 25.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.842 0.857 . . . . 0.0 110.384 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 52.9 ttm -132.52 140.15 48.2 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.889 1.676 . . . . 0.0 109.285 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.15 110.23 3.31 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 124.884 1.23 . . . . 0.0 112.838 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.8 mt -130.55 124.37 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 49.59 53.67 12.33 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.436 2.294 . . . . 0.0 109.233 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 59.95 11.8 2.79 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.861 2.065 . . . . 0.0 114.825 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -119.43 132.89 55.9 Favored 'General case' 0 CA--C 1.514 -0.405 0 O-C-N 120.95 -1.094 . . . . 0.0 109.715 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -86.17 115.82 23.98 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -108.44 132.2 54.02 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.179 0.992 . . . . 0.0 110.56 -178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.9 ttpt -65.26 151.17 46.85 Favored 'General case' 0 C--O 1.238 0.449 0 O-C-N 122.053 -0.405 . . . . 0.0 111.023 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pt -117.25 133.22 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.26 157.7 55.11 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 125.274 1.43 . . . . 0.0 109.208 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.27 153.78 56.43 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.031 3.154 . . . . 0.0 110.846 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.57 -17.93 57.08 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.111 0.564 . . . . 0.0 111.544 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.9 m -77.0 -20.73 55.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.057 -0.497 . . . . 0.0 111.993 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.77 -0.16 41.85 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.901 0.773 . . . . 0.0 110.737 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.44 ' HE2' ' CD1' ' A' ' 27' ' ' PHE . 61.7 mmtt -59.98 150.75 28.07 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 102.09 -31.9 8.16 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 109.136 -1.585 . . . . 0.0 109.136 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.2 -19.36 14.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.93 1.692 . . . . 0.0 110.167 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.79 154.16 10.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 127.407 2.283 . . . . 0.0 106.854 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -131.34 170.87 14.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.718 1.607 . . . . 0.0 108.622 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.43 165.2 14.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.9 168.4 13.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -113.25 140.23 48.14 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 125.159 1.384 . . . . 0.0 109.454 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.47 -13.2 61.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -56.93 -26.72 59.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.949 0.9 . . . . 0.0 111.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -64.38 -19.65 65.62 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.197 1.399 . . . . 0.0 112.821 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.375 1.87 . . . . 0.0 111.646 -177.012 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt . . . . . 0 N--CA 1.463 0.21 0 CA-C-O 121.512 0.672 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -90.55 118.7 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -84.59 100.65 11.56 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.42 138.94 40.68 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -64.95 -34.67 78.96 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 115.351 1.611 . . . . 0.0 115.351 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 57.86 139.86 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.899 2.079 . . . . 0.0 114.751 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.36 15.87 52.97 Favored Glycine 0 CA--C 1.534 1.273 0 O-C-N 121.156 -0.965 . . . . 0.0 111.965 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.11 177.33 7.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 127.644 2.378 . . . . 0.0 108.914 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -167.31 0.49 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 131.038 3.735 . . . . 0.0 109.24 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.285 24.2 p -78.76 119.07 21.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 123.771 1.748 . . . . 0.0 106.985 -176.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.13 139.75 2.87 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 130.974 3.71 . . . . 0.0 107.676 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -162.6 156.75 21.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 128.116 2.566 . . . . 0.0 107.08 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.2 mp -118.92 126.24 75.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 123.618 0.767 . . . . 0.0 108.971 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -131.5 138.66 49.06 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.291 1.036 . . . . 0.0 110.046 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.9 t70 54.05 34.16 19.24 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.343 1.857 . . . . 0.0 113.071 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 66.02 31.48 9.03 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 0.0 110.923 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -134.62 127.66 31.62 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 126.168 1.787 . . . . 0.0 106.641 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.6 m -76.16 132.11 39.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.95 172.59 9.27 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 127.951 2.5 . . . . 0.0 111.797 -177.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.316 25.9 p90 -153.19 144.79 23.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 129.486 3.114 . . . . 0.0 113.63 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.3 t -82.52 133.84 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.6 p -103.57 167.88 9.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.694 1.198 . . . . 0.0 110.107 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -72.14 -12.0 61.0 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.895 1.678 . . . . 0.0 113.201 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 111.44 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.911 1.284 . . . . 0.0 113.238 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 57.7 tt0 -89.92 146.71 24.2 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.424 1.49 . . . . 0.0 109.29 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.68 140.04 24.84 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.697 1.599 . . . . 0.0 107.929 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.81 150.35 61.69 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.817 . . . . 0.0 110.672 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -61.37 -19.42 61.84 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.51 -21.44 60.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.375 0.67 . . . . 0.0 110.588 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.69 -20.04 26.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.836 0.454 . . . . 0.0 111.554 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.0 t -61.3 130.45 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -89.87 -57.96 2.68 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.505 1.122 . . . . 0.0 110.5 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -164.05 172.33 13.96 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.079 0.952 . . . . 0.0 110.514 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.8 p -68.16 162.7 24.25 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -137.28 -45.07 0.56 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.33 122.81 2.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 118.598 0.635 . . . . 0.0 112.069 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -99.9 112.13 24.41 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -150.05 156.45 41.69 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 129.302 3.041 . . . . 0.0 104.893 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -131.8 119.36 21.15 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.443 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -148.12 135.12 20.21 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.443 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.1 tt -137.88 138.18 38.81 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 127.238 2.215 . . . . 0.0 109.147 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -144.42 169.65 17.53 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.991 0.916 . . . . 0.0 110.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.59 128.29 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.042 1.337 . . . . 0.0 107.957 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.67 134.68 65.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 124.799 1.24 . . . . 0.0 108.839 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -76.92 124.24 27.47 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 54.4 mtp -68.79 -29.76 68.18 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 120.255 -1.528 . . . . 0.0 112.887 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -79.48 -53.33 6.99 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.526 0.73 . . . . 0.0 110.784 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -81.48 -17.03 50.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.95 -1.024 . . . . 0.0 111.76 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 59.87 37.44 21.69 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.28 0.945 . . . . 0.0 109.664 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -129.42 161.38 30.5 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.411 1.084 . . . . 0.0 112.392 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.47 147.08 40.13 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.119 0.887 . . . . 0.0 110.061 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.764 ' CD1' ' HG ' ' A' ' 66' ' ' SER . 81.8 mt -131.54 170.49 14.65 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.801 1.24 . . . . 0.0 112.112 -178.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.83 -44.8 8.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.1 161.12 22.3 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.217 1.007 . . . . 0.0 112.665 -177.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.8 p -80.71 96.59 6.96 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -77.23 168.21 20.44 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 105.585 -2.006 . . . . 0.0 105.585 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -69.95 -23.32 63.17 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -80.93 2.95 24.52 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.764 ' HG ' ' CD1' ' A' ' 59' ' ' LEU . 2.5 m -119.28 161.0 21.15 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.653 1.181 . . . . 0.0 112.581 -177.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 55.9 t -136.66 154.95 32.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 126.501 1.92 . . . . 0.0 106.144 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.65 143.47 37.67 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -125.54 145.52 50.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -116.46 103.06 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -101.81 94.54 5.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.97 -173.35 2.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.176 -177.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 51.35 68.09 0.85 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.058 0.943 . . . . 0.0 113.241 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mt -74.68 143.86 12.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 124.903 1.281 . . . . 0.0 109.155 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -136.64 170.22 16.42 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.381 2.272 . . . . 0.0 109.868 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -116.97 157.77 25.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 126.316 1.846 . . . . 0.0 107.699 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.29 165.47 15.43 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.38 1.472 . . . . 0.0 111.463 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.5 t -56.08 -36.32 67.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.587 1.555 . . . . 0.0 111.326 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -87.99 17.93 4.59 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.667 0.787 . . . . 0.0 110.969 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt 67.61 3.25 3.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.372 1.869 . . . . 0.0 111.914 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.0 m -68.63 154.87 41.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.2 mt -114.63 147.58 39.35 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.4 p -142.52 169.08 18.25 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.734 0.414 . . . . 0.0 110.987 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 tpp -128.79 140.15 51.85 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.085 2.154 . . . . 0.0 108.464 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -88.27 115.63 4.43 Favored Glycine 0 N--CA 1.462 0.391 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.403 HG21 HD21 ' A' ' 87' ' ' ASN . 45.5 mt -132.09 119.98 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.403 HD21 HG21 ' A' ' 86' ' ' ILE . 9.7 m-80 50.5 47.09 24.65 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 122.1 0.953 . . . . 0.0 111.139 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 62.7 9.94 3.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 128.69 2.796 . . . . 0.0 113.672 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -112.08 125.3 53.95 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.613 1.565 . . . . 0.0 107.989 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -86.14 116.03 24.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.43 132.11 54.1 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.573 1.149 . . . . 0.0 109.402 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -63.61 155.46 29.62 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.465 0.706 . . . . 0.0 112.632 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -124.62 132.69 70.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.29 160.05 59.57 Favored Pre-proline 0 N--CA 1.474 0.767 0 C-N-CA 126.026 1.73 . . . . 0.0 110.248 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.52 152.32 78.62 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 109.835 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -60.64 -14.82 22.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.56 -0.257 . . . . 0.0 111.666 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.92 -13.64 62.55 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.283 -0.886 . . . . 0.0 110.953 177.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -2.75 40.53 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.829 1.195 . . . . 0.0 111.277 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp -52.47 152.16 3.72 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 120.846 -1.159 . . . . 0.0 110.954 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.68 -42.34 3.04 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -95.65 -14.0 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.211 1.506 . . . . 0.0 110.9 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 20.0 t -143.13 155.06 16.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 C-N-CA 126.818 2.047 . . . . 0.0 106.996 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -133.75 162.38 32.12 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.208 1.003 . . . . 0.0 109.08 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.33 159.7 26.19 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 165.09 13.56 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -125.27 140.34 52.92 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.455 ' CD1' ' H ' ' A' ' 107' ' ' LEU . 0.0 OUTLIER -65.04 -12.85 55.13 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 126.369 1.868 . . . . 0.0 112.692 179.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.31 -16.68 48.31 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.417 1.008 . . . . 0.0 112.15 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -81.49 -5.02 57.53 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 110.981 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.873 2.069 . . . . 0.0 107.045 -179.705 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.37 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.2 t -124.45 144.16 35.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 124.414 1.086 . . . . 0.0 110.26 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -112.56 138.13 49.8 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -113.41 152.17 30.4 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.69 -25.84 68.12 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.659 0.784 . . . . 0.0 111.622 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.8 137.99 0.03 OUTLIER 'General case' 0 C--O 1.236 0.383 0 C-N-CA 129.327 3.051 . . . . 0.0 112.022 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.95 38.04 30.38 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.881 1.229 . . . . 0.0 111.545 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -139.82 179.04 6.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.347 1.859 . . . . 0.0 112.307 -176.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -74.67 -169.19 0.82 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.532 2.733 . . . . 0.0 107.91 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.254 22.8 p -80.16 120.46 24.32 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 119.385 -2.072 . . . . 0.0 109.363 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -168.83 143.41 3.18 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 129.604 3.161 . . . . 0.0 106.548 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 41.3 p90 -164.44 173.17 12.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 119.285 0.948 . . . . 0.0 109.139 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -130.67 123.27 54.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 O-C-N 121.538 -0.726 . . . . 0.0 109.512 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -137.26 145.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 104.632 -2.358 . . . . 0.0 104.632 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.1 t0 53.47 35.33 20.38 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 122.419 1.104 . . . . 0.0 111.399 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 57.59 22.83 8.61 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.347 1.859 . . . . 0.0 113.126 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -123.41 150.77 43.36 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.618 1.567 . . . . 0.0 109.305 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.8 m -79.29 123.05 27.08 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.402 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 8.4 m-85 -127.5 161.35 28.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.423 1.489 . . . . 0.0 109.087 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.433 ' CE2' HG22 ' A' ' 29' ' ' THR . 31.3 p90 -149.17 167.38 26.12 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.004 -1.06 . . . . 0.0 108.408 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -97.45 127.58 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.433 HG22 ' CE2' ' A' ' 27' ' ' PHE . 30.3 p -94.99 167.49 11.36 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.752 1.221 . . . . 0.0 111.689 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -75.15 -13.0 60.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.978 1.711 . . . . 0.0 111.988 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -69.59 102.77 1.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.645 1.578 . . . . 0.0 109.6 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -89.93 145.64 24.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.47 139.93 22.55 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.599 1.959 . . . . 0.0 108.823 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.59 148.61 20.59 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.26 2.64 . . . . 0.0 109.893 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -55.27 -31.97 61.99 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.26 -19.39 64.51 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.58 0.752 . . . . 0.0 112.629 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -101.84 -9.76 20.48 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.523 0.729 . . . . 0.0 111.064 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.6 t -74.87 124.2 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -73.66 -59.57 2.65 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.375 1.07 . . . . 0.0 110.799 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.19 169.07 6.58 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 126.172 1.789 . . . . 0.0 109.63 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 57.5 p -62.48 169.61 2.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.301 1.84 . . . . 0.0 112.913 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -140.51 -47.71 0.43 Allowed 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 116.746 -1.597 . . . . 0.0 114.364 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 t -153.06 130.02 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 121.248 1.84 . . . . 0.0 111.416 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -99.29 106.13 18.22 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.296 1.038 . . . . 0.0 111.042 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -128.87 158.04 39.87 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 129.65 3.18 . . . . 0.0 106.166 178.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.03 109.83 6.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.487 1.04 . . . . 0.0 109.761 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.494 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.36 139.0 22.85 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.985 0.811 . . . . 0.0 109.898 178.037 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.494 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.2 tt -133.53 141.76 47.89 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.465 1.506 . . . . 0.0 108.53 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -148.92 171.16 16.78 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.183 1.393 . . . . 0.0 110.74 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.4 mt -127.3 142.57 43.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.76 1.224 . . . . 0.0 110.725 -178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.484 ' C ' ' HG ' ' A' ' 66' ' ' SER . 4.5 t -137.48 128.83 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.711 1.204 . . . . 0.0 111.712 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -73.62 111.48 8.8 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.801 1.64 . . . . 0.0 108.041 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 63.0 mtp -56.99 -25.22 57.96 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.355 1.434 . . . . 0.0 113.494 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? -60.09 -53.52 56.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.947 0.499 . . . . 0.0 111.05 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.5 m -106.12 -6.54 18.53 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 59.57 30.84 20.51 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.803 2.041 . . . . 0.0 109.878 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.94 154.01 24.71 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 124.923 1.289 . . . . 0.0 112.34 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.11 150.1 49.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.22 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.3 mt -127.45 174.31 9.11 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 124.417 1.087 . . . . 0.0 110.781 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -108.96 0.45 20.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.802 2.041 . . . . 0.0 113.028 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.1 p -163.01 162.98 26.22 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.543 1.137 . . . . 0.0 108.413 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.7 m -91.72 117.43 29.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.486 1.914 . . . . 0.0 112.818 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -124.35 157.22 35.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.97 1.708 . . . . 0.0 109.317 177.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -56.28 -18.03 9.39 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -96.66 4.18 52.04 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.364 0.666 . . . . 0.0 111.072 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.484 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 22.5 t -120.32 169.53 10.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.995 2.118 . . . . 0.0 107.92 -179.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 92.5 t -143.47 145.38 22.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 t -95.46 142.18 28.13 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 106.479 -1.675 . . . . 0.0 106.479 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.2 mt -123.6 151.73 42.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.7 t -128.49 104.33 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 105.332 -2.099 . . . . 0.0 105.332 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -97.94 95.12 7.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.601 1.092 . . . . 0.0 109.837 -178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.49 -167.75 0.93 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 56.0 67.9 0.94 Allowed 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.418 1.087 . . . . 0.0 113.701 175.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.3 mt -77.87 139.99 17.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 121.195 -0.941 . . . . 0.0 109.038 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.82 168.41 19.88 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.834 2.054 . . . . 0.0 109.229 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -115.23 151.22 34.87 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 126.363 1.865 . . . . 0.0 107.204 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.12 159.99 16.43 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.527 1.531 . . . . 0.0 109.837 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -59.54 -33.24 71.15 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.986 0.914 . . . . 0.0 110.779 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -83.05 17.0 2.1 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.877 1.271 . . . . 0.0 110.405 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp 68.65 2.09 3.29 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.84 2.056 . . . . 0.0 111.142 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 44.3 m -70.01 160.98 30.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.95 146.09 41.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.542 1.137 . . . . 0.0 108.145 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.2 p -142.48 167.14 22.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.542 -0.724 . . . . 0.0 110.609 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 36.0 ttm -134.13 137.47 44.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.552 1.941 . . . . 0.0 109.029 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.6 123.38 6.03 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 127.336 2.398 . . . . 0.0 111.087 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.7 mt -138.98 117.32 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 50.67 43.69 27.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.901 0.881 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 73.94 -1.28 3.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.123 2.569 . . . . 0.0 115.357 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -105.45 134.76 48.04 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.968 1.307 . . . . 0.0 108.6 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -89.89 117.09 28.45 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.12 0.568 . . . . 0.0 109.819 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -109.02 130.24 55.47 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.289 1.436 . . . . 0.0 110.742 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -62.89 147.76 49.29 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.308 0.643 . . . . 0.0 110.387 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -115.95 133.46 62.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.21 161.05 56.56 Favored Pre-proline 0 C--O 1.236 0.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.952 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -74.95 144.29 30.26 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 122.696 2.264 . . . . 0.0 109.05 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -58.11 -18.18 23.31 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.78 -11.1 59.99 Favored 'General case' 0 N--CA 1.445 -0.71 0 O-C-N 121.006 -1.059 . . . . 0.0 112.571 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.5 1.66 28.5 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.34 1.427 . . . . 0.0 112.426 178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -46.11 144.42 1.94 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 126.606 1.962 . . . . 0.0 112.279 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.43 -43.11 1.94 Allowed Glycine 0 CA--C 1.518 0.251 0 C-N-CA 127.172 2.32 . . . . 0.0 110.662 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.06 -18.17 22.1 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 117.936 0.868 . . . . 0.0 110.457 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.0 t -138.62 158.1 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 125.832 1.653 . . . . 0.0 107.713 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -141.98 168.63 19.28 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 127.938 2.495 . . . . 0.0 106.629 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.63 -179.66 1.46 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.744 0.783 . . . . 0.0 111.038 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.95 173.25 10.23 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -123.39 141.86 51.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.719 1.208 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.97 -8.84 52.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.403 0.681 . . . . 0.0 111.787 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.24 -22.37 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.964 1.706 . . . . 0.0 110.942 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.97 -5.57 49.16 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.833 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 124.843 1.257 . . . . 0.0 111.556 -177.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.421 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 14.6 ttmm . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.421 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 24.1 t -126.71 126.12 68.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -91.67 135.72 33.67 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -106.18 165.35 11.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.49 -33.54 48.11 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 53.19 98.08 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.996 1.718 . . . . 0.0 113.386 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 9.25 37.46 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 125.466 1.508 . . . . 0.0 112.955 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.9 m -131.6 178.68 6.55 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 127.39 2.276 . . . . 0.0 109.469 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.4 -167.9 0.48 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 130.733 3.613 . . . . 0.0 107.833 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.4 p -78.87 121.13 24.44 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 124.317 2.008 . . . . 0.0 109.642 -176.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -167.0 143.84 4.58 Favored 'General case' 0 N--CA 1.448 -0.558 1 C-N-CA 132.299 4.24 . . . . 0.0 104.6 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -165.2 171.26 13.9 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 125.044 1.338 . . . . 0.0 107.447 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -132.72 123.53 49.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 O-C-N 121.558 -0.714 . . . . 0.0 109.533 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -128.07 136.64 51.49 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 125.515 1.526 . . . . 0.0 107.019 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.4 t70 52.45 34.95 16.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.272 1.429 . . . . 0.0 110.355 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 64.64 12.73 7.78 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.795 2.038 . . . . 0.0 112.593 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -106.38 138.08 43.2 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 126.216 1.807 . . . . 0.0 108.299 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -68.72 136.64 53.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -144.9 159.27 43.17 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.976 0.911 . . . . 0.0 109.275 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -149.36 164.26 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.394 -0.816 . . . . 0.0 109.174 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 t -97.63 132.31 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.27 175.57 5.43 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.379 0.609 . . . . 0.0 109.729 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -77.06 -11.09 59.76 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.38 1.072 . . . . 0.0 113.208 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.19 110.97 5.48 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.211 1.004 . . . . 0.0 108.871 178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -98.88 143.42 29.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.2 mp -118.75 136.19 24.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.67 159.44 52.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.931 2.421 . . . . 0.0 112.905 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -61.83 -27.75 68.99 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -71.77 -22.67 61.56 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.946 0.794 . . . . 0.0 110.093 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -84.47 -24.7 29.35 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -64.81 147.07 12.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -112.08 -60.97 1.78 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.602 1.161 . . . . 0.0 110.937 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -153.93 168.01 27.82 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.391 0.676 . . . . 0.0 112.486 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 p -69.87 147.57 50.13 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 126.12 1.768 . . . . 0.0 109.196 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -119.25 -52.6 2.28 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 117.791 -1.1 . . . . 0.0 111.404 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 t -149.11 118.59 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 119.787 1.176 . . . . 0.0 112.598 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -86.03 101.45 12.94 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 177.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.49 158.23 34.99 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 128.834 2.854 . . . . 0.0 107.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -141.12 108.16 5.45 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 120.21 1.368 . . . . 0.0 111.984 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.531 ' HE2' ' CD2' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -148.13 138.58 22.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.325 -0.859 . . . . 0.0 110.432 178.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -130.76 145.08 51.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 127.467 2.307 . . . . 0.0 108.15 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.531 ' CD2' ' HE2' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -150.24 171.34 17.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.394 1.877 . . . . 0.0 109.03 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.0 mt -128.22 131.93 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 124.433 1.093 . . . . 0.0 108.104 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.59 130.21 74.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.296 1.038 . . . . 0.0 111.01 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.63 122.61 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 127.244 2.217 . . . . 0.0 110.109 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.0 mmm -69.25 -21.8 63.88 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -83.07 -53.26 5.94 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.495 1.118 . . . . 0.0 110.991 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.3 m -92.4 -11.01 36.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.105 -178.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 60.89 23.43 13.48 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 120.073 1.306 . . . . 0.0 110.766 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 mtpp -110.98 162.7 14.58 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.944 1.298 . . . . 0.0 111.371 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.98 146.57 41.57 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.29 0.636 . . . . 0.0 110.88 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.405 HD13 ' HG ' ' A' ' 66' ' ' SER . 70.5 mt -135.22 174.98 10.01 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.87 1.668 . . . . 0.0 109.761 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.9 m -115.09 -8.65 12.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.607 1.163 . . . . 0.0 110.455 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.6 m -116.92 127.11 53.92 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.569 1.148 . . . . 0.0 113.086 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.1 t -80.13 99.23 7.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -121.41 166.84 13.52 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.369 0.668 . . . . 0.0 109.984 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -56.5 -36.78 69.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -87.73 18.53 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.065 0.546 . . . . 0.0 110.401 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.405 ' HG ' HD13 ' A' ' 59' ' ' LEU . 35.8 t -138.37 154.46 48.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 126.173 1.789 . . . . 0.0 108.678 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.64 139.87 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.052 0.941 . . . . 0.0 109.194 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.71 144.37 26.04 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.938 0.895 . . . . 0.0 109.543 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -136.15 150.47 49.07 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.013 1.325 . . . . 0.0 107.519 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 t -125.37 103.35 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.29 95.26 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.59 -174.82 4.65 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.81 68.95 0.48 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.73 2.012 . . . . 0.0 114.616 178.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.6 mt -68.9 145.36 13.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.679 1.192 . . . . 0.0 110.107 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -140.12 169.69 17.22 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 128.134 2.574 . . . . 0.0 110.414 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -115.78 163.68 15.48 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 127.781 2.432 . . . . 0.0 108.672 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -120.86 168.64 11.25 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.799 2.04 . . . . 0.0 109.994 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -57.3 -36.93 71.69 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.97 18.78 2.84 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.874 1.27 . . . . 0.0 111.403 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt 66.14 9.86 6.61 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.065 1.346 . . . . 0.0 112.261 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 t -73.92 137.92 43.95 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -100.18 150.46 22.49 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 122.974 0.51 . . . . 0.0 109.808 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.1 p -145.68 171.11 15.2 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.802 0.441 . . . . 0.0 112.117 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.9 ttm -137.18 142.17 42.17 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.1 1.76 . . . . 0.0 110.644 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.81 129.55 9.14 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 124.772 1.177 . . . . 0.0 110.824 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.9 mt -147.6 126.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 50.69 39.99 23.03 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.765 0.826 . . . . 0.0 110.396 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 63.54 15.55 8.93 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.975 2.11 . . . . 0.0 114.755 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -118.22 140.34 49.95 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 125.495 1.518 . . . . 0.0 107.388 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -91.33 116.15 28.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.903 -0.498 . . . . 0.0 110.81 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.28 127.25 53.38 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.975 1.31 . . . . 0.0 109.769 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.98 154.65 21.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.184 0.993 . . . . 0.0 110.216 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -120.24 132.66 69.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -120.42 155.47 56.36 Favored Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 124.486 1.114 . . . . 0.0 110.286 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.35 147.87 60.04 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.706 2.271 . . . . 0.0 107.864 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.11 -18.43 47.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.136 0.426 . . . . 0.0 111.919 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.6 t -67.51 -21.61 65.48 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 121.301 -0.875 . . . . 0.0 109.964 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -79.66 -3.11 45.79 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.119 0.968 . . . . 0.0 113.392 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -52.62 155.87 2.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.313 1.054 . . . . 0.0 109.571 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.85 -42.51 2.65 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.24 -32.47 24.44 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 p -137.7 162.37 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 C-N-CA 125.957 1.703 . . . . 0.0 108.955 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -136.31 170.61 15.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.922 2.489 . . . . 0.0 107.529 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.11 166.24 2.95 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.797 0.808 . . . . 0.0 110.699 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.15 171.9 3.39 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.177 0.591 . . . . 0.0 111.558 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -127.29 136.29 51.76 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.722 0.809 . . . . 0.0 111.162 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.32 -21.32 65.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 124.342 1.057 . . . . 0.0 112.2 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -60.05 -10.85 4.72 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -81.9 -0.43 43.73 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.867 0.758 . . . . 0.0 109.81 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.245 0.839 0 C-N-CA 127.579 2.352 . . . . 0.0 107.914 -179.454 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.286 0 CA-C-O 120.598 0.237 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.8 t -132.96 130.62 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.7 ttm-85 -102.6 115.83 31.36 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -86.81 166.77 14.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -75.19 -33.04 61.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.933 0.788 . . . . 0.0 112.104 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 60.41 117.73 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.297 1.839 . . . . 0.0 114.295 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.63 18.96 78.54 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -137.94 178.04 7.42 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.938 1.695 . . . . 0.0 111.184 -178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -74.18 -168.38 0.63 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 128.707 2.803 . . . . 0.0 108.937 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.4 p -79.12 120.16 23.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.436 2.065 . . . . 0.0 107.849 -176.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -168.64 145.76 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 130.353 3.461 . . . . 0.0 105.941 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -165.21 174.91 9.75 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.215 2.206 . . . . 0.0 106.771 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 73.2 mt -135.44 128.28 47.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -137.09 140.63 42.09 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.2 t70 51.83 39.19 25.16 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.9 1.68 . . . . 0.0 112.489 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.61 16.78 10.66 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.629 1.572 . . . . 0.0 112.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -120.2 141.87 49.52 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.872 1.269 . . . . 0.0 110.08 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.9 m -72.33 127.42 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.691 1.597 . . . . 0.0 108.706 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -140.39 160.03 40.89 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.565 0.746 . . . . 0.0 112.34 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -148.8 162.57 39.53 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 121.21 -0.931 . . . . 0.0 111.189 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.2 t -92.23 127.55 44.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 124.097 0.959 . . . . 0.0 109.894 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.8 p -98.97 171.13 8.24 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.817 1.247 . . . . 0.0 109.863 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -81.17 -10.9 59.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.998 1.719 . . . . 0.0 112.598 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.29 111.5 5.94 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.552 1.941 . . . . 0.0 109.692 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.8 tt0 -95.96 146.36 24.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.309 1.444 . . . . 0.0 111.864 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.99 131.77 24.01 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.748 2.419 . . . . 0.0 107.253 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.95 156.28 47.82 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.591 2.86 . . . . 0.0 112.484 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -58.26 -26.6 63.12 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.085 0.954 . . . . 0.0 113.5 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.41 -26.21 63.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.317 0.508 . . . . 0.0 110.665 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -82.82 -25.33 32.79 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.56 118.2 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.014 0.925 . . . . 0.0 108.598 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.77 -61.04 2.12 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.049 0.94 . . . . 0.0 109.776 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -159.75 173.63 15.73 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.86 0.864 . . . . 0.0 109.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.421 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 70.0 m -62.91 171.36 2.2 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.024 1.33 . . . . 0.0 110.933 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -145.79 -45.03 0.21 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 120.559 -1.338 . . . . 0.0 113.746 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.2 t -152.44 132.88 4.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-N 118.983 0.811 . . . . 0.0 109.693 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -109.52 109.01 19.69 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.094 1.358 . . . . 0.0 107.782 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -139.39 157.41 45.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 127.894 2.478 . . . . 0.0 107.274 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -125.27 107.48 10.76 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -145.59 122.72 11.46 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.835 0.743 . . . . 0.0 109.332 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.4 tt -129.73 143.36 50.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 128.548 2.739 . . . . 0.0 106.575 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.23 170.54 19.77 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 126.047 1.739 . . . . 0.0 107.245 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.5 mt -129.22 132.02 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.1 t -121.98 136.16 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.047 1.339 . . . . 0.0 108.755 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -78.85 119.04 21.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 126.001 1.72 . . . . 0.0 109.301 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.9 mtp -68.44 -19.53 64.58 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 121.789 2.086 . . . . 0.0 111.531 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -38.27 69.08 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 117.914 -1.041 . . . . 0.0 113.638 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.3 p -121.98 -9.06 8.79 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 60.31 41.19 16.74 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 125.969 1.707 . . . . 0.0 111.024 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -122.47 158.26 30.15 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.902 1.281 . . . . 0.0 109.491 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.02 146.95 49.07 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.02 0.528 . . . . 0.0 111.734 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.6 mt -132.64 158.17 42.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.704 1.602 . . . . 0.0 110.3 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -86.75 -21.84 26.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.524 0.73 . . . . 0.0 110.726 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -135.95 146.79 47.65 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.462 1.505 . . . . 0.0 111.246 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.64 98.85 11.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 127.595 2.358 . . . . 0.0 112.03 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -97.08 171.76 8.27 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.8 -0.563 . . . . 0.0 110.155 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -53.61 -21.89 7.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.697 2.399 . . . . 0.0 117.462 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -105.73 1.17 26.86 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.578 1.951 . . . . 0.0 110.675 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.7 t -114.69 161.83 17.62 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.974 1.71 . . . . 0.0 110.63 -177.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.2 t -138.55 126.46 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 124.612 1.165 . . . . 0.0 109.284 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.9 t -77.31 143.09 39.07 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.9 mt -130.21 145.41 51.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.38 103.69 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.26 93.03 6.66 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.31 -162.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 44.17 67.28 0.7 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.699 1.999 . . . . 0.0 111.482 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 mt -75.14 142.64 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.427 1.091 . . . . 0.0 110.105 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.421 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 73.6 m-85 -141.87 158.6 43.59 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -103.03 165.5 10.99 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.718 1.207 . . . . 0.0 110.104 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.24 169.99 12.31 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.733 0.813 . . . . 0.0 112.736 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -58.78 -41.1 85.88 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.245 1.418 . . . . 0.0 109.814 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.03 13.24 5.22 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.579 1.951 . . . . 0.0 109.797 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.46 10.98 5.23 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.85 2.06 . . . . 0.0 110.922 -177.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.2 m -65.41 149.58 49.76 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -111.32 140.23 46.06 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.13 175.2 9.82 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.818 0.847 . . . . 0.0 112.086 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.8 ttm -134.83 142.14 46.57 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.9 2.08 . . . . 0.0 108.967 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.65 125.78 8.09 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.953 -1.659 . . . . 0.0 108.953 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.2 mt -142.6 121.53 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 48.35 54.94 9.59 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.254 1.421 . . . . 0.0 113.51 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 69.25 -2.84 1.71 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.88 1.672 . . . . 0.0 114.712 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -112.78 156.7 22.41 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 125.129 1.372 . . . . 0.0 109.469 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.69 117.0 29.6 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.14 0.976 . . . . 0.0 109.396 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.76 133.64 52.91 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.269 1.428 . . . . 0.0 112.175 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ttpt -63.1 145.07 56.25 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.757 0.823 . . . . 0.0 110.877 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -110.36 132.63 58.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -126.46 156.32 73.07 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.19 161.8 42.18 Favored 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 122.247 1.965 . . . . 0.0 111.057 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -21.25 66.46 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.56 -6.04 37.77 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.024 1.33 . . . . 0.0 112.579 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.33 -3.94 36.05 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.374 0.988 . . . . 0.0 111.69 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 20.1 mmtm -54.47 156.96 3.06 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-N 119.596 1.089 . . . . 0.0 111.873 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 108.49 -42.81 1.85 Allowed Glycine 0 CA--C 1.521 0.464 0 N-CA-C 108.396 -1.882 . . . . 0.0 108.396 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.37 -42.25 8.99 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.1 159.96 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 125.617 1.567 . . . . 0.0 110.77 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -143.07 173.29 11.7 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.694 2.798 . . . . 0.0 107.0 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.6 164.88 4.18 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.655 1.182 . . . . 0.0 110.359 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 172.96 3.89 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -116.97 127.39 54.15 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 125.385 1.474 . . . . 0.0 108.655 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.434 HD13 ' H ' ' A' ' 107' ' ' LEU . 0.5 OUTLIER -64.93 -20.17 66.32 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.578 0.751 . . . . 0.0 111.121 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -55.04 -24.86 26.91 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.54 1.536 . . . . 0.0 111.782 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -68.86 -16.0 63.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.495 -0.753 . . . . 0.0 110.416 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 125.999 1.72 . . . . 0.0 109.789 -178.98 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt . . . . . 0 C--O 1.232 0.18 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.43 135.89 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.1 ttt-85 -107.91 98.52 8.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -82.24 148.92 28.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.55 -33.73 73.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 117.885 -1.055 . . . . 0.0 112.686 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 79.06 131.07 0.05 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 129.7 3.2 . . . . 0.0 114.281 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.41 34.49 54.64 Favored Glycine 0 CA--C 1.522 0.501 0 C-N-CA 126.088 1.804 . . . . 0.0 111.196 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.9 p -137.83 178.48 7.08 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 110.575 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.78 -170.08 0.65 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.891 2.076 . . . . 0.0 109.328 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.3 p -79.6 120.22 23.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 123.927 1.822 . . . . 0.0 108.535 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -167.44 149.95 5.98 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 130.976 3.71 . . . . 0.0 105.014 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 42.7 p90 -172.88 175.86 3.22 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.4 mt -134.56 130.94 53.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -130.61 138.15 49.97 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.6 t0 47.57 42.97 15.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.747 1.619 . . . . 0.0 113.832 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 61.0 22.51 12.75 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 0.0 112.877 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -122.9 128.64 50.6 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.222 1.809 . . . . 0.0 106.623 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 71.2 m -74.75 132.25 41.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -130.35 166.28 20.75 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 127.013 2.125 . . . . 0.0 110.348 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -148.54 166.35 28.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -99.63 126.93 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.2 p -93.26 171.18 9.08 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.896 0.878 . . . . 0.0 110.291 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -77.86 -15.67 58.87 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.463 1.505 . . . . 0.0 111.53 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.8 122.77 18.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.991 1.317 . . . . 0.0 110.618 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.454 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 32.6 tt0 -111.0 145.68 38.02 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.227 1.411 . . . . 0.0 110.394 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.64 141.23 27.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.651 1.18 . . . . 0.0 108.654 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.99 152.15 51.19 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.208 2.605 . . . . 0.0 110.352 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.55 -33.04 63.5 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.475 ' HG3' HD21 ' A' ' 37' ' ' ASN . 9.4 pt-20 -64.56 -20.8 66.46 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.475 HD21 ' HG3' ' A' ' 36' ' ' GLU . 2.3 m-80 -90.97 -15.38 29.81 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.566 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.2 t -70.9 123.75 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.906 0.882 . . . . 0.0 108.623 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -62.04 1.72 Allowed 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.87 173.01 14.27 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.135 0.88 . . . . 0.0 110.825 178.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.5 p -65.34 135.78 55.72 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 125.49 1.516 . . . . 0.0 110.206 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.98 -49.39 3.14 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 116.996 -1.478 . . . . 0.0 112.656 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.8 t -143.92 122.01 6.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 120.185 1.357 . . . . 0.0 112.052 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -83.05 114.31 21.2 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.11 158.84 44.58 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 127.828 2.451 . . . . 0.0 109.623 -178.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -143.44 119.75 10.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.011 0.924 . . . . 0.0 109.434 178.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -148.08 136.61 21.57 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -133.59 144.71 49.46 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.338 1.855 . . . . 0.0 109.072 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.3 169.67 24.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.016 1.327 . . . . 0.0 109.551 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.9 mt -126.43 136.0 62.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 125.492 1.517 . . . . 0.0 107.898 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.2 t -134.82 134.25 53.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 125.911 1.684 . . . . 0.0 109.991 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -72.13 116.81 12.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 127.917 2.487 . . . . 0.0 111.699 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.7 mtp -68.24 -18.28 64.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.128 0.876 . . . . 0.0 112.176 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -66.43 -53.78 31.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.818 1.19 . . . . 0.0 111.372 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.7 m -122.6 8.61 9.53 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 59.44 47.09 11.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.227 1.811 . . . . 0.0 112.939 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -116.64 147.17 42.17 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.368 1.067 . . . . 0.0 108.883 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mp -69.52 155.8 39.9 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.628 ' CD1' HD22 ' A' ' 63' ' ' ASN . 86.8 mt -135.36 157.81 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.723 1.209 . . . . 0.0 110.465 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.9 p -88.1 -12.44 44.13 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.285 -1.34 . . . . 0.0 114.194 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 p -147.66 148.99 31.64 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 121.136 1.789 . . . . 0.0 112.31 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -69.77 116.97 10.77 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.862 1.265 . . . . 0.0 109.393 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.628 HD22 ' CD1' ' A' ' 59' ' ' LEU . 4.4 p30 -137.43 156.64 47.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.18 1.392 . . . . 0.0 109.806 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -54.44 -31.64 55.84 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -80.39 3.57 20.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.322 0.965 . . . . 0.0 111.311 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -124.47 177.01 6.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.934 1.694 . . . . 0.0 111.616 -177.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.0 t -142.46 150.28 18.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 127.959 2.503 . . . . 0.0 105.831 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.8 t -102.61 140.63 36.63 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.32 144.84 50.3 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 t -115.9 103.32 15.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.87 94.37 8.9 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.361 -1.462 . . . . 0.0 107.39 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.25 -173.76 3.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -177.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 46.45 69.46 0.48 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.335 1.854 . . . . 0.0 114.815 177.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.3 mt -70.01 143.87 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.53 169.39 17.87 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.775 2.03 . . . . 0.0 108.833 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -117.96 154.13 32.46 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.28 161.07 16.4 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.526 1.13 . . . . 0.0 110.009 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -65.78 -13.36 59.27 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.274 0.63 . . . . 0.0 111.421 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 2.89 56.41 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.224 1.41 . . . . 0.0 109.472 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm 79.6 -1.59 2.16 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 129.157 2.983 . . . . 0.0 112.11 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.5 m -77.35 162.38 27.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 120.55 1.523 . . . . 0.0 108.099 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.17 158.43 17.44 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.224 1.01 . . . . 0.0 109.639 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.3 p -149.32 172.79 14.32 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.037 0.835 . . . . 0.0 109.522 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.3 ttm -136.03 135.85 39.77 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.789 1.636 . . . . 0.0 108.449 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.26 109.88 3.12 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 74.9 mt -123.03 123.81 68.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.9 m120 51.7 37.91 21.41 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.794 1.237 . . . . 0.0 109.609 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 69.24 16.31 8.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.89 2.876 . . . . 0.0 114.554 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -117.17 132.75 56.58 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -86.5 115.92 24.3 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.569 -0.707 . . . . 0.0 110.252 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.454 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 76.4 m-85 -110.21 128.27 55.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.861 1.265 . . . . 0.0 111.295 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.94 144.63 52.76 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.037 0.935 . . . . 0.0 110.315 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.57 132.91 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.36 156.48 57.78 Favored Pre-proline 0 N--CA 1.467 0.384 0 C-N-CA 124.457 1.103 . . . . 0.0 108.658 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -75.12 156.41 42.47 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.23 1.953 . . . . 0.0 108.505 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -65.5 -11.18 41.03 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.464 -0.773 . . . . 0.0 110.958 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -21.93 63.81 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.166 -0.959 . . . . 0.0 109.503 177.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.9 -7.39 59.6 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.483 1.113 . . . . 0.0 111.823 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -56.07 149.33 15.84 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 107.87 -32.05 7.43 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -178.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.97 -8.97 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.416 1.486 . . . . 0.0 111.887 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -150.54 150.2 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 C-N-CA 126.404 1.882 . . . . 0.0 107.13 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -131.06 169.67 15.55 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.765 1.626 . . . . 0.0 107.994 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.65 163.4 11.44 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.126 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.35 167.65 10.16 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt85 -110.36 135.67 50.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 126.148 1.779 . . . . 0.0 110.753 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -68.77 -15.58 63.55 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -59.03 -23.02 61.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.186 1.794 . . . . 0.0 111.441 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.5 m-20 -73.57 -6.02 43.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 118.341 -0.837 . . . . 0.0 111.981 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.565 1.546 . . . . 0.0 111.755 -177.822 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 121.217 0.532 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.3 t -110.12 130.55 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -89.15 116.97 27.8 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -85.08 153.3 22.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -59.66 -34.34 72.71 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 128.109 2.564 . . . . 0.0 113.96 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 59.66 103.64 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 127.944 2.498 . . . . 0.0 113.704 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.93 31.84 69.84 Favored Glycine 0 CA--C 1.528 0.88 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.279 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -134.71 179.88 6.02 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.397 1.879 . . . . 0.0 112.659 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.53 -168.59 0.45 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.155 2.582 . . . . 0.0 107.502 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -78.46 120.37 23.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 116.993 -1.883 . . . . 0.0 108.295 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -168.06 146.68 4.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 128.949 2.899 . . . . 0.0 107.808 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -170.87 177.05 3.92 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.321 0.964 . . . . 0.0 109.429 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 44.1 mt -135.65 126.28 43.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 121.446 -0.784 . . . . 0.0 109.031 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -129.86 134.24 47.4 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 105.576 -2.009 . . . . 0.0 105.576 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.8 t0 53.15 38.09 26.64 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.255 1.022 . . . . 0.0 112.49 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 m120 62.57 16.02 8.43 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.482 2.313 . . . . 0.0 113.112 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -111.4 136.95 49.82 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.46 1.104 . . . . 0.0 108.796 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -71.55 122.24 20.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.449 1.5 . . . . 0.0 107.611 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -134.48 162.33 32.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.181 1.393 . . . . 0.0 109.957 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.416 ' CE2' HG22 ' A' ' 29' ' ' THR . 25.2 p90 -149.27 171.89 15.76 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.397 1.079 . . . . 0.0 108.527 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 t -100.82 125.26 54.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.416 HG22 ' CE2' ' A' ' 27' ' ' PHE . 8.5 p -96.52 170.47 9.19 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.521 1.129 . . . . 0.0 111.081 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -77.72 -9.44 59.0 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.185 1.794 . . . . 0.0 112.961 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -70.19 97.46 1.21 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.858 1.263 . . . . 0.0 108.523 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -89.14 145.1 25.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 123.655 0.782 . . . . 0.0 109.672 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.95 142.77 33.91 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 126.514 1.926 . . . . 0.0 112.399 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.79 146.82 30.35 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 123.836 3.024 . . . . 0.0 109.728 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -53.99 -31.52 51.2 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.741 1.216 . . . . 0.0 113.874 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.72 -29.06 69.53 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.317 -0.864 . . . . 0.0 111.1 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -84.58 -15.46 45.57 Favored 'General case' 0 C--O 1.23 0.053 0 O-C-N 121.157 -0.964 . . . . 0.0 109.109 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.4 t -77.18 114.04 17.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.414 HD21 ' C ' ' A' ' 39' ' ' ASN . 0.1 OUTLIER -68.09 -61.26 1.94 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 124.915 1.286 . . . . 0.0 109.5 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.2 169.47 20.71 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.402 1.001 . . . . 0.0 110.502 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 p -71.58 151.72 43.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -118.58 -38.78 3.08 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.492 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 t -147.57 140.87 19.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 118.548 0.613 . . . . 0.0 111.905 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -113.88 93.95 4.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 125.596 1.558 . . . . 0.0 107.875 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -140.24 156.46 46.48 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 128.35 2.66 . . . . 0.0 105.549 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -131.01 126.49 36.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.291 1.836 . . . . 0.0 108.709 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE3' HD22 ' A' ' 71' ' ' LEU . 0.6 OUTLIER -147.37 129.99 15.96 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 tt -134.55 144.51 48.03 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.977 1.711 . . . . 0.0 108.175 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.45 169.88 23.6 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 125.918 1.687 . . . . 0.0 107.8 178.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -128.01 134.71 64.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 119.56 1.073 . . . . 0.0 108.343 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.406 ' C ' ' HG ' ' A' ' 66' ' ' SER . 21.6 t -124.63 133.68 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 125.061 1.344 . . . . 0.0 110.617 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -71.69 119.3 15.65 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.858 2.063 . . . . 0.0 108.506 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.1 mtp -68.72 -17.34 64.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.871 0.76 . . . . 0.0 112.684 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 7.4 mmpt? -79.81 -53.93 6.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.302 1.41 . . . . 0.0 112.47 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.6 m -97.31 -7.72 31.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 66.31 14.91 9.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.018 1.727 . . . . 0.0 110.846 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -99.11 155.25 17.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 125.631 1.572 . . . . 0.0 111.454 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.5 mp -74.0 157.46 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 177.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.7 mt -126.68 -174.4 3.12 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.794 1.238 . . . . 0.0 112.091 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -13.77 15.92 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.465 1.906 . . . . 0.0 113.525 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 p -149.37 -172.41 4.13 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.615 1.166 . . . . 0.0 108.505 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.5 t -113.86 106.82 14.9 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -109.41 164.41 12.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 125.187 1.395 . . . . 0.0 109.061 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -10.96 6.04 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.682 1.593 . . . . 0.0 114.732 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.03 14.71 20.81 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.583 1.083 . . . . 0.0 109.001 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.406 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 17.4 t -131.87 167.18 20.04 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.51 1.524 . . . . 0.0 109.898 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -140.87 135.23 33.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 125.215 1.406 . . . . 0.0 109.0 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 t -79.43 142.9 35.5 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.8 mt -132.85 133.16 42.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -113.16 103.44 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 103.228 -2.879 . . . . 0.0 103.228 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.433 HD22 ' HE3' ' A' ' 47' ' ' LYS . 1.9 mm? -97.93 91.89 5.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 -178.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.87 -163.76 0.74 Allowed 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -176.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 54.13 67.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.963 0.887 . . . . 0.0 112.109 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.7 mt -80.79 133.71 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.346 -0.846 . . . . 0.0 110.239 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -133.39 169.71 16.54 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.566 1.946 . . . . 0.0 110.093 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -117.66 150.31 39.26 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.881 2.072 . . . . 0.0 109.745 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.99 168.49 9.02 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 126.86 2.064 . . . . 0.0 110.214 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.5 m -53.85 -37.95 64.17 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.242 1.017 . . . . 0.0 113.449 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -85.76 11.91 10.1 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 126.136 1.775 . . . . 0.0 113.211 -177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.7 mptt 74.73 1.21 3.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.921 1.689 . . . . 0.0 110.223 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.8 t -71.21 152.33 43.45 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 104.821 -2.288 . . . . 0.0 104.821 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.28 153.17 24.25 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.628 0.771 . . . . 0.0 109.744 -178.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.6 p -139.62 168.33 20.06 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.517 1.127 . . . . 0.0 109.647 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.9 ttm -133.83 138.35 45.6 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.075 1.75 . . . . 0.0 109.703 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.27 118.84 4.71 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 127.279 2.371 . . . . 0.0 111.184 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.7 mt -137.0 119.66 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 51.48 44.21 29.15 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.625 0.77 . . . . 0.0 109.264 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 56.6 m-20 62.41 17.83 9.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.054 2.142 . . . . 0.0 114.676 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -118.48 131.27 56.25 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 124.371 1.068 . . . . 0.0 109.113 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -86.74 116.29 24.74 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 122.338 0.255 . . . . 0.0 111.031 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -109.08 123.63 49.48 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.272 2.229 . . . . 0.0 109.547 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -59.92 142.38 53.77 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.725 1.61 . . . . 0.0 111.289 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -110.45 133.66 55.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -129.36 163.42 46.45 Favored Pre-proline 0 N--CA 1.468 0.459 0 C-N-CA 125.886 1.675 . . . . 0.0 110.999 -177.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.59 152.22 37.82 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.68 2.253 . . . . 0.0 111.084 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.4 -6.34 4.72 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -15.44 59.69 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.63 -1.293 . . . . 0.0 110.929 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -73.01 -4.25 31.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -45.71 138.76 4.45 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 127.15 2.18 . . . . 0.0 111.06 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 101.77 -26.81 23.1 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.92 -18.62 8.16 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.402 1.081 . . . . 0.0 111.985 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -140.74 157.11 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -145.93 167.44 23.28 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 127.039 2.135 . . . . 0.0 107.767 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.18 162.46 5.86 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.258 0.623 . . . . 0.0 110.561 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.98 168.64 13.3 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.891 -0.506 . . . . 0.0 111.502 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -111.7 139.72 46.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.972 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.3 mp -68.82 -13.35 62.36 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 123.836 0.854 . . . . 0.0 111.019 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -60.27 -23.04 63.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.174 0.99 . . . . 0.0 111.943 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -71.47 -7.48 47.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.341 1.056 . . . . 0.0 110.99 -177.114 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.236 0.388 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -112.23 144.7 19.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -119.44 96.93 5.41 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -76.22 155.09 34.74 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.197 -2.149 . . . . 0.0 105.197 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -62.39 -33.33 74.55 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 74.41 123.95 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.919 2.088 . . . . 0.0 110.431 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.83 35.07 38.5 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.466 1.031 . . . . 0.0 113.533 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -140.17 -179.65 6.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.172 2.589 . . . . 0.0 109.335 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -72.67 -168.35 0.44 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.287 2.235 . . . . 0.0 111.27 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.277 22.0 p -79.21 118.18 20.91 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -176.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -169.28 140.5 2.36 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 126.781 2.032 . . . . 0.0 108.218 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.9 p90 -160.68 169.61 22.49 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.22 126.65 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 107.661 -1.236 . . . . 0.0 107.661 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -138.43 136.1 35.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.2 t0 55.16 41.39 31.59 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.011 1.325 . . . . 0.0 112.271 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 59.77 28.16 17.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.507 1.523 . . . . 0.0 111.644 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -130.95 142.76 50.38 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.403 1.081 . . . . 0.0 110.993 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.1 m -70.19 126.59 30.11 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.366 1.866 . . . . 0.0 107.767 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 5.5 m-85 -137.57 160.23 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.996 0.918 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 29' ' ' THR . 21.8 p90 -149.63 165.29 32.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.998 0.919 . . . . 0.0 109.007 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.5 t -94.65 128.64 45.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.916 -0.49 . . . . 0.0 109.779 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.499 HG23 ' CE2' ' A' ' 27' ' ' PHE . 17.6 p -96.27 166.47 11.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.001 1.32 . . . . 0.0 111.962 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -76.87 -10.03 59.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.021 1.328 . . . . 0.0 112.443 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -71.69 98.94 2.02 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.396 1.479 . . . . 0.0 108.038 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -89.98 142.92 27.24 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.12 140.87 26.2 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.963 1.705 . . . . 0.0 107.966 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.26 149.18 50.91 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.247 1.965 . . . . 0.0 109.909 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -57.71 -23.55 52.35 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -73.14 -23.67 60.5 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.931 -0.481 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.47 -14.82 39.4 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.654 1.182 . . . . 0.0 109.976 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.98 122.73 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.21 -61.51 1.79 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.09 168.35 13.72 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.931 1.292 . . . . 0.0 110.569 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.1 p -65.14 160.36 21.41 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.41 ' HE3' HD11 ' A' ' 82' ' ' LEU . 20.5 ttmm -128.21 -50.01 1.31 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 117.492 -1.242 . . . . 0.0 111.347 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -143.2 136.65 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 120.021 1.282 . . . . 0.0 111.691 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mtmm -104.24 114.83 29.34 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.613 1.965 . . . . 0.0 109.201 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -146.8 157.91 43.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 127.613 2.365 . . . . 0.0 108.988 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 108.29 5.65 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.274 0.943 . . . . 0.0 110.58 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.19 142.24 27.08 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.8 tt -135.15 145.27 47.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 127.979 2.512 . . . . 0.0 109.382 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.48 170.37 17.0 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.89 1.676 . . . . 0.0 108.755 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.98 136.73 59.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 125.49 1.516 . . . . 0.0 108.621 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -137.19 134.77 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.285 0.634 . . . . 0.0 109.956 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.81 125.35 29.59 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.403 1.081 . . . . 0.0 108.458 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 81.7 mtp -65.94 -16.22 63.67 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.965 1.257 . . . . 0.0 112.934 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -63.36 -53.79 47.03 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.094 0.861 . . . . 0.0 111.719 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 t -122.69 9.44 9.54 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 56.53 38.21 29.45 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.767 1.167 . . . . 0.0 110.085 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -105.86 143.03 34.58 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 125.223 1.409 . . . . 0.0 108.676 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.72 153.72 41.03 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.819 0.818 . . . . 0.0 111.092 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.7 mt -135.25 157.6 46.49 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.629 -1.168 . . . . 0.0 110.803 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.24 -20.88 33.7 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.815 1.246 . . . . 0.0 110.973 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 m -149.22 140.32 23.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.077 0.951 . . . . 0.0 108.454 -178.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.64 119.0 19.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.551 1.54 . . . . 0.0 110.404 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -107.28 172.0 7.07 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 126.329 1.852 . . . . 0.0 107.438 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -56.74 -26.45 57.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.717 1.376 . . . . 0.0 114.717 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -92.86 4.17 54.36 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.491 0.716 . . . . 0.0 111.754 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 43.0 t -117.62 166.69 12.1 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.569 1.548 . . . . 0.0 113.314 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.5 t -137.53 148.25 25.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 127.046 2.139 . . . . 0.0 106.545 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -101.91 143.4 31.85 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -130.86 136.82 49.0 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 t -116.04 101.96 12.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.72 96.7 9.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.915 1.286 . . . . 0.0 107.957 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.58 -161.76 0.25 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 118.41 0.55 . . . . 0.0 112.398 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 52.42 66.76 1.12 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.639 1.976 . . . . 0.0 112.281 176.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.3 mt -81.55 135.12 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.184 -0.948 . . . . 0.0 111.277 -178.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -139.36 161.97 36.15 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.637 1.975 . . . . 0.0 109.729 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -104.67 155.43 18.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.517 1.527 . . . . 0.0 108.606 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.59 163.92 12.82 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.419 1.887 . . . . 0.0 109.75 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.1 p -57.76 -34.2 69.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.378 0.671 . . . . 0.0 112.809 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -80.55 11.63 3.62 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.038 0.935 . . . . 0.0 110.582 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 71.19 12.04 6.83 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 127.878 2.471 . . . . 0.0 110.29 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.13 167.14 20.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.41 HD11 ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -119.12 148.4 43.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.637 1.175 . . . . 0.0 109.553 -178.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 17.5 p -147.2 167.23 24.72 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.476 0.71 . . . . 0.0 110.161 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.4 ttm -133.85 137.55 45.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 126.313 1.845 . . . . 0.0 108.198 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.54 121.2 5.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 125.298 1.428 . . . . 0.0 109.82 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.0 mt -136.72 120.62 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 51.42 51.22 17.26 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.586 1.954 . . . . 0.0 110.103 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t0 59.86 15.89 5.26 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.015 1.726 . . . . 0.0 114.134 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -121.09 139.18 53.67 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 125.266 1.426 . . . . 0.0 109.389 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -96.72 116.43 29.12 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 118.331 0.514 . . . . 0.0 111.391 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -106.89 125.84 51.53 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.26 1.424 . . . . 0.0 109.491 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -60.71 146.32 46.22 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.155 0.982 . . . . 0.0 109.697 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.3 pt -115.9 132.93 63.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -129.19 165.16 34.34 Favored Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 124.713 1.205 . . . . 0.0 112.33 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.96 148.81 32.14 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.819 2.346 . . . . 0.0 110.176 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -58.65 -15.32 11.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.404 0.682 . . . . 0.0 112.703 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.2 m -72.66 -14.91 61.69 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 120.762 -1.211 . . . . 0.0 112.055 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.42 -4.07 43.48 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.799 -1.188 . . . . 0.0 111.445 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -53.96 150.24 8.07 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.994 1.318 . . . . 0.0 108.941 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.6 1.81 63.7 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -148.86 -49.89 0.15 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.018 2.527 . . . . 0.0 106.259 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 t -109.3 161.51 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.152 0.981 . . . . 0.0 109.068 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -150.67 170.51 19.01 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 127.097 2.159 . . . . 0.0 108.864 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.62 169.11 2.54 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.203 1.001 . . . . 0.0 112.174 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.31 174.94 9.57 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.587 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.1 mtt85 -125.12 141.69 51.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 O-C-N 121.887 -0.508 . . . . 0.0 110.79 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.468 HD13 ' H ' ' A' ' 107' ' ' LEU . 0.4 OUTLIER -63.12 -22.04 66.59 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.312 1.045 . . . . 0.0 110.936 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -57.29 -16.57 8.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -76.77 -3.11 36.52 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.336 0.655 . . . . 0.0 110.495 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.253 1.252 0 C-N-CA 127.719 2.408 . . . . 0.0 107.729 -178.987 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? . . . . . 0 C--O 1.234 0.271 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -104.07 130.45 54.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -98.23 111.94 24.09 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -87.04 158.88 19.13 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.85 -33.93 75.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 75.2 128.11 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.352 2.261 . . . . 0.0 112.348 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.99 34.83 39.32 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 125.737 1.637 . . . . 0.0 112.249 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.9 m -139.89 178.47 7.23 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 125.928 1.691 . . . . 0.0 112.096 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -73.65 -169.45 0.7 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.116 1.767 . . . . 0.0 108.764 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.6 p -79.67 120.88 24.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 119.658 -1.901 . . . . 0.0 110.574 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -168.23 144.41 3.84 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 130.172 3.389 . . . . 0.0 106.596 178.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 31.7 p90 -165.79 165.43 18.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.5 mp -120.57 131.3 73.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 123.784 0.834 . . . . 0.0 109.148 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -144.45 143.91 31.12 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 50.64 34.31 9.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 112.638 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 58.01 33.52 23.28 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 112.384 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -130.61 146.3 52.09 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.062 1.745 . . . . 0.0 106.864 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 m -74.44 140.81 44.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.8 m-85 -139.54 159.23 42.65 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 125.643 1.577 . . . . 0.0 109.523 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -148.91 165.69 30.8 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.021 -1.05 . . . . 0.0 109.799 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.9 t -101.26 128.24 53.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 p -99.71 172.39 7.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.356 1.462 . . . . 0.0 109.05 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -78.05 -15.58 58.79 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.624 1.97 . . . . 0.0 112.273 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -67.31 116.33 7.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.514 1.126 . . . . 0.0 110.681 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.24 148.26 23.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.969 1.708 . . . . 0.0 111.47 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm -116.4 127.77 26.5 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 126.594 1.958 . . . . 0.0 109.419 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.63 146.74 68.25 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.7 2.267 . . . . 0.0 109.477 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -55.93 -27.64 53.2 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.6 -23.78 67.52 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.535 0.734 . . . . 0.0 111.574 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -95.12 -19.07 20.41 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.63 139.21 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.456 ' ND2' HD21 ' A' ' 40' ' ' ASN . 0.2 OUTLIER -93.36 -60.94 1.66 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.258 -179.685 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.456 HD21 ' ND2' ' A' ' 39' ' ' ASN . 6.7 p30 -163.43 166.04 23.22 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.65 0.78 . . . . 0.0 111.668 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 p -70.76 126.74 30.42 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -101.51 -42.16 6.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 55.3 t -142.64 127.95 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 119.105 0.866 . . . . 0.0 108.877 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -100.38 117.37 34.43 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -149.93 157.08 42.82 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 131.282 3.833 . . . . 0.0 105.197 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -137.21 115.39 11.67 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 104.052 -2.574 . . . . 0.0 104.052 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -146.77 133.52 20.01 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.6 tt -137.58 145.63 43.08 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.876 1.67 . . . . 0.0 108.215 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.88 169.31 25.06 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 125.909 1.683 . . . . 0.0 106.48 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.5 mt -127.97 137.41 57.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 C-N-CA 125.617 1.567 . . . . 0.0 107.111 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -130.55 140.22 49.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.71 126.98 33.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 84.2 mtp -67.62 -18.69 65.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -72.22 -44.61 62.67 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -122.13 0.84 9.68 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.61 30.28 18.56 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.885 1.274 . . . . 0.0 111.068 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -99.05 147.05 25.43 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.88 0.872 . . . . 0.0 110.0 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.91 146.95 43.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mp -124.43 177.58 5.83 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.379 1.472 . . . . 0.0 110.397 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 t -116.9 -3.25 11.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.978 1.311 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 p -144.7 162.34 36.96 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 120.219 1.372 . . . . 0.0 109.129 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.8 t -92.76 115.4 28.08 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -124.44 161.59 25.71 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -56.45 -19.93 17.49 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -93.08 -4.33 52.58 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.92 0.888 . . . . 0.0 110.753 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 m -113.7 160.09 19.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.484 1.514 . . . . 0.0 113.771 -176.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 25.3 t -137.07 146.59 27.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 125.191 1.397 . . . . 0.0 108.826 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -85.75 141.37 29.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -129.98 100.75 5.56 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 105.887 -1.894 . . . . 0.0 105.887 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.87 102.41 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 103.203 -2.888 . . . . 0.0 103.203 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.32 93.71 8.35 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.656 -0.418 . . . . 0.0 112.005 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 47.1 67.38 0.8 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.012 1.725 . . . . 0.0 111.723 177.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.2 mt -77.45 140.12 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.538 -1.351 . . . . 0.0 109.591 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -134.15 169.67 16.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.753 2.021 . . . . 0.0 111.01 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -113.06 170.8 7.95 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.017 2.127 . . . . 0.0 109.601 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.61 161.24 26.67 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.747 2.019 . . . . 0.0 108.272 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -60.57 -26.88 67.27 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.504 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -93.53 28.49 2.27 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.49 1.916 . . . . 0.0 111.32 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 59.35 3.19 0.36 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.328 1.851 . . . . 0.0 112.93 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.7 m -73.49 152.86 40.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.49 150.09 35.37 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.297 0.639 . . . . 0.0 110.773 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.0 p -144.69 169.44 18.0 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.901 0.88 . . . . 0.0 110.619 178.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.0 ttm -134.46 136.24 43.06 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 126.391 1.876 . . . . 0.0 109.328 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.48 110.38 3.28 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 125.502 1.525 . . . . 0.0 111.439 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.2 mt -123.68 119.16 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 49.49 51.81 15.69 Favored 'General case' 0 C--O 1.23 0.076 0 C-N-CA 124.689 1.195 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 70.31 -6.22 1.2 Allowed 'General case' 0 C--O 1.24 0.561 0 C-N-CA 128.046 2.538 . . . . 0.0 115.525 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -105.41 133.74 49.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.396 1.453 . . . . 0.0 110.646 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -85.67 116.66 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.455 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -115.85 132.53 56.61 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.504 1.122 . . . . 0.0 112.219 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -60.53 142.38 55.41 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.833 1.253 . . . . 0.0 111.19 -179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.7 135.5 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -130.18 159.3 71.01 Favored Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 123.954 0.902 . . . . 0.0 108.818 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.0 161.18 45.32 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.312 2.008 . . . . 0.0 109.831 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.17 -13.07 32.77 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 110.472 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -63.34 -24.36 67.82 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.216 1.806 . . . . 0.0 109.555 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -10.69 59.99 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.828 1.251 . . . . 0.0 111.183 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.9 mmtt -59.26 161.49 5.42 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 120.682 -1.261 . . . . 0.0 109.941 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.7 -35.11 4.18 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -124.15 -5.92 7.81 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.3 t -135.51 156.81 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 126.515 1.926 . . . . 0.0 105.863 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -138.6 165.45 26.87 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.892 1.677 . . . . 0.0 108.131 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.88 166.42 15.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.02 167.31 10.04 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -106.89 132.29 53.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 125.886 1.674 . . . . 0.0 110.474 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mt -67.38 -21.41 65.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.311 0.644 . . . . 0.0 109.984 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -60.07 -20.42 58.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.901 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -67.09 -16.93 64.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.97 0.804 . . . . 0.0 112.293 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.691 1.996 . . . . 0.0 111.33 -177.387 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.7 t -64.44 143.71 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 O-C-N 121.825 -0.547 . . . . 0.0 110.183 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -117.12 105.6 12.44 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -84.63 153.61 23.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -67.18 -33.96 76.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.571 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 63.31 135.62 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.93 3.292 . . . . 0.0 112.408 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.95 24.35 74.4 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m -138.83 178.64 7.01 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.706 2.002 . . . . 0.0 112.286 -178.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.44 -169.02 0.6 Allowed 'General case' 0 C--O 1.24 0.599 0 C-N-CA 129.096 2.958 . . . . 0.0 107.694 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.258 35.2 p -79.32 119.39 22.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 117.534 -1.666 . . . . 0.0 108.324 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -169.2 147.74 3.83 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 130.212 3.405 . . . . 0.0 107.033 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -168.13 171.41 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 126.351 1.86 . . . . 0.0 107.979 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -126.68 127.74 70.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -141.08 147.24 38.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.9 t70 54.92 32.15 17.35 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.252 1.821 . . . . 0.0 109.691 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 66.64 15.56 10.15 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 127.576 2.35 . . . . 0.0 113.357 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -123.66 154.77 38.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 124.395 1.078 . . . . 0.0 109.588 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.1 t -79.34 141.93 36.52 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -144.59 155.78 43.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.711 2.004 . . . . 0.0 111.493 -178.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -148.8 151.23 34.42 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 120.904 -1.122 . . . . 0.0 110.529 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 t -81.11 127.96 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 123.997 0.919 . . . . 0.0 110.626 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.3 p -98.14 164.4 12.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.803 1.241 . . . . 0.0 109.035 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.68 -12.37 61.3 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 126.506 1.922 . . . . 0.0 113.295 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.95 112.31 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.584 1.553 . . . . 0.0 109.208 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -96.83 146.92 24.46 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.719 0.808 . . . . 0.0 109.451 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.04 135.22 22.08 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.604 1.962 . . . . 0.0 109.139 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.3 151.58 29.88 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.452 2.768 . . . . 0.0 111.564 178.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -58.5 -22.6 55.59 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.528 0.731 . . . . 0.0 112.749 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -67.45 -25.84 66.1 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.937 -0.477 . . . . 0.0 110.517 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -90.63 -20.01 23.02 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 111.399 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.1 t -65.13 126.15 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.444 ' ND2' HD21 ' A' ' 40' ' ' ASN . 0.2 OUTLIER -83.47 -61.3 1.88 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.733 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.444 HD21 ' ND2' ' A' ' 39' ' ' ASN . 4.5 p30 -163.87 168.95 18.86 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 126.159 1.783 . . . . 0.0 109.16 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.442 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 15.9 m -63.16 155.35 28.36 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.155 0.982 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -120.42 -54.73 2.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.737 -0.602 . . . . 0.0 110.592 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.2 t -146.99 146.81 18.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.58 125.38 53.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 104.047 -2.575 . . . . 0.0 104.047 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 158.43 44.06 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 126.274 1.83 . . . . 0.0 111.343 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.87 112.83 15.15 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.571 ' HE3' ' CD2' ' A' ' 49' ' ' LEU . 4.0 tmtm? -147.99 115.9 6.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.45 1.1 . . . . 0.0 109.113 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -131.78 134.77 46.2 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.112 1.365 . . . . 0.0 107.823 178.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.571 ' CD2' ' HE3' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -148.53 170.97 16.88 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.853 1.661 . . . . 0.0 108.425 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -129.28 129.6 67.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.5 t -120.93 134.03 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.67 1.188 . . . . 0.0 108.966 -178.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -80.68 126.03 30.77 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.03 -1.043 . . . . 0.0 109.574 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 76.5 mtp -68.23 -17.79 64.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.608 1.549 . . . . 0.0 113.808 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -65.0 -52.03 58.37 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.164 0.893 . . . . 0.0 111.094 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -122.19 6.25 9.71 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 60.66 24.79 14.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.484 1.514 . . . . 0.0 112.353 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -93.27 151.15 19.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 120.931 -1.106 . . . . 0.0 109.157 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.8 146.21 49.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.6 mt -130.42 -179.59 5.35 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.328 2.251 . . . . 0.0 108.253 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.8 m -131.78 -5.06 3.62 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.693 1.197 . . . . 0.0 112.281 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -123.71 174.63 7.36 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.041 1.736 . . . . 0.0 106.963 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 t -109.28 110.44 21.63 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.262 87.5 m-20 -102.65 159.38 15.51 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.355 1.462 . . . . 0.0 107.747 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -70.52 -12.87 61.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.211 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -100.62 5.52 43.9 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.439 1.472 . . . . 0.0 110.55 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.7 t -113.78 173.75 6.27 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.012 1.725 . . . . 0.0 112.053 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.5 t -142.59 130.41 19.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 125.731 1.612 . . . . 0.0 107.784 178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -75.04 135.09 41.27 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -125.84 132.33 52.24 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 120.8 -1.187 . . . . 0.0 108.332 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -113.31 107.84 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.53 92.04 3.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.909 1.232 . . . . 0.0 110.981 -178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.14 -164.34 0.53 Allowed 'General case' 0 CA--C 1.508 -0.672 0 O-C-N 121.199 -0.938 . . . . 0.0 111.736 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.94 66.79 0.87 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 123.882 0.739 . . . . 0.0 111.636 176.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 6.7 mt -79.61 138.61 19.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.442 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.3 m-85 -134.69 168.83 18.3 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.13 1.772 . . . . 0.0 107.768 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -110.9 157.9 19.34 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.486 1.514 . . . . 0.0 108.141 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.77 162.59 17.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 125.348 1.459 . . . . 0.0 109.457 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.1 t -56.42 -29.98 62.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.486 0.714 . . . . 0.0 111.098 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -85.08 12.29 8.04 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.82 -1.175 . . . . 0.0 112.517 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm 75.3 1.99 3.79 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.546 1.939 . . . . 0.0 110.462 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 m -74.72 167.69 21.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.439 1.096 . . . . 0.0 110.108 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.78 148.58 45.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.492 1.117 . . . . 0.0 110.204 -178.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.4 p -140.2 171.07 14.69 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.08 0.952 . . . . 0.0 109.414 178.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.5 ttm -131.36 134.65 46.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.357 1.863 . . . . 0.0 110.718 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.24 103.78 2.53 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 126.743 2.116 . . . . 0.0 110.573 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 65.7 mt -117.43 113.97 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.899 1.68 . . . . 0.0 108.074 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 47.84 54.01 10.57 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 124.743 1.217 . . . . 0.0 112.585 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 75.21 -4.64 2.33 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.518 1.927 . . . . 0.0 115.473 178.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -115.85 147.48 40.99 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.378 1.445 . . . . 0.0 109.626 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -99.85 116.92 33.04 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -108.09 133.44 52.37 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.964 1.305 . . . . 0.0 111.176 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -67.87 151.09 47.72 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.19 -0.944 . . . . 0.0 110.059 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -118.58 133.66 64.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -119.59 156.75 53.25 Favored Pre-proline 0 N--CA 1.467 0.39 0 C-N-CA 125.238 1.415 . . . . 0.0 108.848 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.51 156.1 64.93 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.483 2.122 . . . . 0.0 109.888 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.36 65.18 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.577 -0.702 . . . . 0.0 109.68 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.0 t -70.88 -0.7 9.71 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.107 0.963 . . . . 0.0 110.516 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.97 -3.77 31.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.033 -1.667 . . . . 0.0 112.959 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -53.05 164.41 0.41 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.606 1.193 . . . . 0.0 112.701 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.62 -41.77 3.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 125.118 1.342 . . . . 0.0 111.823 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.75 -28.24 19.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.417 1.087 . . . . 0.0 110.573 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.9 p -134.02 162.9 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 127.38 2.272 . . . . 0.0 106.402 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -134.39 172.56 12.72 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.818 2.447 . . . . 0.0 106.875 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.68 168.71 14.3 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.23 172.51 6.85 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.711 -0.618 . . . . 0.0 112.46 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -118.22 138.88 52.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.341 1.056 . . . . 0.0 110.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.85 -13.13 61.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.162 0.585 . . . . 0.0 110.04 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -61.48 -10.13 7.11 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.243 2.217 . . . . 0.0 113.18 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -96.1 -4.65 42.45 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.726 0.81 . . . . 0.0 112.706 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 C--O 1.25 1.099 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.226 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.2 t -99.13 137.15 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -102.46 103.05 13.4 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 103.688 -2.708 . . . . 0.0 103.688 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -80.59 166.63 20.94 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.493 1.117 . . . . 0.0 110.697 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -59.24 -33.58 71.18 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.709 1.604 . . . . 0.0 113.798 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 51.19 91.96 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.101 2.56 . . . . 0.0 113.477 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 65.07 38.7 95.67 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 113.748 -1.569 . . . . 0.0 111.904 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.0 m -139.38 -179.89 6.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.349 2.259 . . . . 0.0 109.647 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.66 -170.07 0.8 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.617 1.567 . . . . 0.0 108.358 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 33.8 p -79.49 121.76 25.6 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 123.994 1.854 . . . . 0.0 110.438 -175.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -167.14 149.42 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 129.584 3.154 . . . . 0.0 107.234 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -164.27 167.27 20.11 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -131.53 112.83 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 O-C-N 120.452 -1.405 . . . . 0.0 108.278 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -117.55 137.07 52.83 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.067 0.947 . . . . 0.0 108.608 178.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.3 t70 55.25 34.22 22.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.175 1.79 . . . . 0.0 114.042 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 69.78 17.65 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.844 2.458 . . . . 0.0 111.933 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -119.08 138.24 53.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.963 1.705 . . . . 0.0 106.944 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.2 m -82.42 136.95 34.83 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -137.67 166.41 24.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.561 1.944 . . . . 0.0 112.125 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -148.99 163.66 36.86 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.495 0.718 . . . . 0.0 110.725 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 t -96.01 122.52 47.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 124.785 1.234 . . . . 0.0 108.466 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.78 172.82 7.01 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.517 1.127 . . . . 0.0 110.009 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -74.9 -14.98 60.71 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 110.95 5.03 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.065 0.946 . . . . 0.0 110.315 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.19 146.81 24.38 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.36 1.064 . . . . 0.0 108.524 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.71 137.17 24.02 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 126.528 1.931 . . . . 0.0 105.946 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.6 153.05 49.02 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.447 2.098 . . . . 0.0 111.47 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.21 -30.19 64.36 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -65.9 -15.6 63.09 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.783 0.719 . . . . 0.0 112.686 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -97.9 -14.44 20.67 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.988 0.915 . . . . 0.0 111.14 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.9 t -78.23 135.35 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 C-N-CA 124.602 1.161 . . . . 0.0 108.001 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.66 -61.34 1.66 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.359 1.464 . . . . 0.0 111.038 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -156.23 158.71 38.01 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.7 t -70.45 131.43 44.04 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttp -101.12 -51.93 3.4 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 117.153 -1.403 . . . . 0.0 114.535 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.9 t -141.39 133.48 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 119.027 0.831 . . . . 0.0 110.191 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.21 117.2 33.43 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.335 1.054 . . . . 0.0 109.445 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -148.77 157.44 43.44 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.628 1.971 . . . . 0.0 110.128 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -123.3 120.71 33.88 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.963 -1.085 . . . . 0.0 108.398 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.4 tptm -147.51 124.02 11.05 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.725 1.21 . . . . 0.0 107.818 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 tt -134.19 143.96 48.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.623 1.969 . . . . 0.0 109.407 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -153.72 169.57 23.0 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 125.369 1.468 . . . . 0.0 107.838 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mt -130.33 133.82 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 125.192 1.397 . . . . 0.0 107.443 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.19 152.49 33.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 125.738 1.615 . . . . 0.0 108.129 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -88.89 124.83 34.58 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.347 1.859 . . . . 0.0 107.327 178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.9 mtp -68.35 -25.95 65.35 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 121.009 1.731 . . . . 0.0 109.863 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -53.56 54.09 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.362 1.065 . . . . 0.0 112.677 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -111.34 -6.14 14.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 65.0 20.2 12.05 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.819 1.19 . . . . 0.0 111.308 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -102.27 153.89 19.55 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.79 1.636 . . . . 0.0 108.637 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.77 154.59 39.51 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.335 0.516 . . . . 0.0 111.393 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.2 mt -135.56 160.28 38.98 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 125.791 1.636 . . . . 0.0 108.809 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -7.98 45.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.4 m -142.18 165.57 27.08 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.737 1.608 . . . . 0.0 110.071 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.4 p -92.39 117.01 29.48 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -132.23 163.06 29.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -47.38 -34.59 7.2 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -80.08 -7.1 58.71 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.829 -1.169 . . . . 0.0 112.634 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.8 t -120.55 164.28 16.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 127.346 2.258 . . . . 0.0 114.035 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -137.32 161.38 34.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 127.012 2.125 . . . . 0.0 106.353 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.1 t -110.87 144.84 39.29 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.016 1.327 . . . . 0.0 109.487 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.1 mt -131.19 144.72 51.56 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.0 t -122.94 101.73 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 101.658 -3.46 . . . . 0.0 101.658 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -87.87 96.07 10.34 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -178.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.01 -161.62 0.33 Allowed 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.59 66.93 1.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.639 1.576 . . . . 0.0 111.455 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 mt -79.36 137.1 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.166 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -134.99 168.86 18.34 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.967 1.707 . . . . 0.0 109.212 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -116.96 147.1 42.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.31 168.47 10.0 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 126.251 1.82 . . . . 0.0 110.637 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.9 t -60.31 -35.15 74.93 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -83.15 18.2 1.78 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.986 1.314 . . . . 0.0 112.178 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 65.26 12.5 8.09 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.256 1.422 . . . . 0.0 110.43 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.8 t -81.29 169.29 17.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.4 mt -123.55 154.99 38.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.413 0.685 . . . . 0.0 112.377 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.4 p -146.98 171.78 14.72 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.901 0.88 . . . . 0.0 110.035 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.2 ttm -133.58 135.98 44.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.368 1.867 . . . . 0.0 108.651 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.0 115.74 4.17 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 126.174 1.845 . . . . 0.0 112.865 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -132.76 122.84 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 55.7 36.92 28.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.39 1.876 . . . . 0.0 110.777 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 t0 70.02 13.82 7.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.14 2.176 . . . . 0.0 114.173 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -116.48 138.54 51.3 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.843 1.657 . . . . 0.0 107.823 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -91.2 116.88 29.17 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.798 -0.564 . . . . 0.0 110.448 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -106.07 124.56 49.77 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.224 1.409 . . . . 0.0 107.597 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.1 ttpp -60.53 157.51 14.1 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.157 -0.964 . . . . 0.0 111.307 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pt -121.99 134.54 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.01 158.74 67.87 Favored Pre-proline 0 N--CA 1.469 0.484 0 C-N-CA 125.093 1.357 . . . . 0.0 107.877 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.08 153.69 67.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.161 1.907 . . . . 0.0 109.171 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.53 -19.79 66.07 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 119.892 -0.723 . . . . 0.0 110.747 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -63.82 -19.46 65.04 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.266 1.426 . . . . 0.0 110.894 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -84.88 2.17 43.84 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -55.5 154.6 6.25 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.883 0.765 . . . . 0.0 110.033 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.76 -21.72 35.7 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.078 0.847 . . . . 0.0 111.83 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.15 -12.43 6.91 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 118.86 1.33 . . . . 0.0 111.182 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -141.35 155.86 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 C-N-CA 125.655 1.582 . . . . 0.0 107.286 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -130.06 164.73 23.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.999 1.72 . . . . 0.0 108.211 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 164.6 12.99 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.48 160.0 11.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.386 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -107.35 133.18 52.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 124.217 1.007 . . . . 0.0 111.275 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.47 -23.06 67.15 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.759 1.224 . . . . 0.0 110.041 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.11 -9.2 2.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.042 1.337 . . . . 0.0 113.664 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -84.43 -8.04 59.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.18 0.992 . . . . 0.0 111.053 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 C--O 1.245 0.86 0 C-N-CA 124.367 1.067 . . . . 0.0 111.17 -176.602 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.536 0.438 0 CA-C-O 121.507 0.67 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.6 t -102.47 115.75 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 102.476 -3.157 . . . . 0.0 102.476 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -80.49 113.75 18.89 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.24 150.5 25.41 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -71.56 -34.05 69.63 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 119.636 -0.826 . . . . 0.0 111.358 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 66.51 137.44 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 128.174 2.59 . . . . 0.0 112.508 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.9 26.04 39.61 Favored Glycine 0 CA--C 1.533 1.172 0 O-C-N 121.294 -0.879 . . . . 0.0 113.202 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 m -140.26 177.68 7.82 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.519 1.928 . . . . 0.0 111.291 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.06 -168.33 0.61 Allowed 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.564 2.345 . . . . 0.0 107.025 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -79.85 121.87 25.95 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.781 -1.824 . . . . 0.0 110.113 -176.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -167.26 146.68 5.2 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 130.792 3.637 . . . . 0.0 105.646 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -168.79 167.4 11.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.259 1.424 . . . . 0.0 108.226 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.5 mt -130.92 113.22 23.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 O-C-N 121.595 -0.691 . . . . 0.0 109.251 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -120.01 139.98 51.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 53.27 33.2 14.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 123.029 1.395 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 56.84 30.14 17.32 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.034 2.534 . . . . 0.0 111.632 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.9 mtpp -123.16 132.37 54.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.682 1.993 . . . . 0.0 105.634 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.5 p -71.45 139.67 49.73 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -145.66 163.08 35.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.156 1.782 . . . . 0.0 109.385 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 p90 -149.14 162.02 40.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -95.75 127.04 48.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -96.57 171.86 8.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.693 1.597 . . . . 0.0 110.574 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.42 -10.25 59.35 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.542 1.937 . . . . 0.0 112.41 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.09 103.55 1.56 Allowed 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 126.081 1.752 . . . . 0.0 110.173 -179.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -94.29 142.25 27.63 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.21 142.63 29.62 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 124.331 1.052 . . . . 0.0 109.389 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -77.9 150.62 27.05 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.649 2.899 . . . . 0.0 110.408 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -54.37 -29.99 50.39 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -63.36 -19.96 65.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.264 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -97.69 -14.05 21.12 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.417 0.553 . . . . 0.0 111.749 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.62 119.84 25.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.24 -61.49 1.97 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.394 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.56 173.74 15.06 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.074 0.95 . . . . 0.0 110.809 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.5 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -63.21 163.47 10.24 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.7 1.2 . . . . 0.0 111.452 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.1 -53.19 0.85 Allowed 'General case' 0 CA--C 1.518 -0.261 0 O-C-N 121.075 -1.016 . . . . 0.0 109.241 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -144.68 132.33 16.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -108.46 92.65 4.14 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.541 1.162 . . . . 0.0 109.569 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -132.09 156.49 46.23 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 128.345 2.658 . . . . 0.0 105.738 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -134.94 118.3 16.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.494 1.918 . . . . 0.0 108.281 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.71 137.62 24.04 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -134.63 145.58 48.74 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.641 1.977 . . . . 0.0 107.839 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -151.54 170.29 20.01 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 107.302 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.5 mt -127.5 128.79 70.17 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.154 0 C-N-CA 123.316 0.646 . . . . 0.0 109.329 -177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.78 137.09 51.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 125.464 1.506 . . . . 0.0 110.554 -178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.88 117.04 23.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 129.284 3.034 . . . . 0.0 111.784 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 70.3 mtp -68.2 -14.49 63.02 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.683 -1.261 . . . . 0.0 112.247 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -69.74 -53.32 18.96 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.827 -1.17 . . . . 0.0 111.53 178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.8 m -122.79 10.53 9.6 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 58.95 21.08 8.82 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.178 1.391 . . . . 0.0 112.873 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 mtmm -96.81 161.73 13.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 123.742 0.817 . . . . 0.0 110.59 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.95 153.61 24.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.1 mt -135.18 160.93 36.8 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.696 1.198 . . . . 0.0 110.437 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -78.84 -25.8 44.11 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.04 0.536 . . . . 0.0 110.4 177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.27 158.66 43.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.505 1.122 . . . . 0.0 108.906 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.09 116.5 27.41 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.78 173.84 9.18 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -63.23 -18.59 63.7 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.137 -0.977 . . . . 0.0 112.238 177.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -103.6 18.18 22.45 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.458 1.503 . . . . 0.0 109.758 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.34 158.57 33.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.246 1.818 . . . . 0.0 108.609 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.0 t -133.31 145.58 33.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 125.068 1.347 . . . . 0.0 107.572 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -93.7 137.23 33.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.66 136.25 49.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 t -107.58 103.35 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 102.998 -2.964 . . . . 0.0 102.998 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -95.9 92.19 6.39 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 -166.06 0.89 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 51.67 67.49 0.95 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 122.557 1.17 . . . . 0.0 112.314 176.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.83 134.35 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.984 -1.073 . . . . 0.0 109.957 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.5 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 40.9 m-85 -135.16 169.86 16.8 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.735 2.014 . . . . 0.0 110.452 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -112.93 159.79 18.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.144 2.178 . . . . 0.0 109.866 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.76 169.56 9.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.218 1.407 . . . . 0.0 110.593 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -25.36 63.49 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.44 0.696 . . . . 0.0 112.011 179.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -98.8 15.15 26.32 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.09 -1.006 . . . . 0.0 112.338 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp 71.69 2.32 4.24 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.969 1.708 . . . . 0.0 112.617 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.7 m -70.28 159.36 34.2 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -114.04 156.66 23.71 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.26 -0.9 . . . . 0.0 111.046 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -143.77 170.96 14.89 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.158 0.983 . . . . 0.0 110.088 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.5 ttm -134.59 137.37 43.68 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 126.618 1.967 . . . . 0.0 108.982 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.86 124.11 6.38 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 126.194 1.854 . . . . 0.0 109.98 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.5 mt -144.18 120.87 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 53.1 45.5 28.58 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.545 0.738 . . . . 0.0 110.843 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.6 t0 60.33 17.65 7.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.52 1.928 . . . . 0.0 113.995 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.1 137.48 54.91 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 126.27 1.828 . . . . 0.0 108.269 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.58 116.99 29.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 122.488 0.315 . . . . 0.0 110.773 -178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -106.19 125.78 51.42 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.288 1.435 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -62.66 145.35 54.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.713 0.805 . . . . 0.0 110.75 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.76 133.01 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 106.079 -1.823 . . . . 0.0 106.079 179.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -124.99 156.57 69.03 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.557 1.143 . . . . 0.0 109.777 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.08 141.64 33.09 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 N-CA-C 107.301 -1.846 . . . . 0.0 107.301 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -58.96 -13.75 7.31 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.7 t -68.8 -16.35 63.77 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.65 -6.2 54.87 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 119.638 1.108 . . . . 0.0 113.473 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -56.03 157.69 4.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.886 0.851 . . . . 0.0 109.719 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.93 -23.5 35.75 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 108.353 -1.899 . . . . 0.0 108.353 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.95 -7.35 13.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.004 2.121 . . . . 0.0 109.393 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 p -156.98 158.01 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 129.083 2.953 . . . . 0.0 105.242 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -135.6 170.66 15.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.979 1.712 . . . . 0.0 106.732 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.1 162.74 11.14 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.541 0.686 . . . . 0.0 110.979 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.17 163.2 3.87 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.498 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 40.9 mtm180 -116.48 139.14 50.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 124.289 1.036 . . . . 0.0 111.684 -177.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.51 -19.62 62.17 Favored 'General case' 0 C--O 1.22 -0.464 0 O-C-N 123.963 0.789 . . . . 0.0 110.797 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.2 -2.88 2.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.417 1.887 . . . . 0.0 113.158 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -93.71 0.57 56.47 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.039 -1.038 . . . . 0.0 110.003 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 125.049 1.339 . . . . 0.0 110.906 -178.046 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? . . . . . 0 C--O 1.237 0.439 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -81.23 138.17 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 124.523 1.129 . . . . 0.0 108.213 -178.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -106.6 133.32 51.46 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -102.55 161.12 13.97 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -66.31 -32.89 74.56 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 64.93 137.85 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 128.627 2.771 . . . . 0.0 112.851 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.34 28.83 44.64 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 t -139.97 178.35 7.32 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.106 2.162 . . . . 0.0 110.923 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.59 -169.49 0.7 Allowed 'General case' 0 C--O 1.246 0.89 1 C-N-CA 132.02 4.128 . . . . 0.0 107.867 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.9 p -80.61 118.84 22.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 116.956 -1.897 . . . . 0.0 108.682 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -169.13 144.95 3.31 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 130.677 3.591 . . . . 0.0 105.676 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.4 p90 -165.49 177.86 7.15 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.555 1.142 . . . . 0.0 108.926 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.9 mt -133.86 125.76 49.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -139.06 140.74 38.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.371 1.468 . . . . 0.0 108.564 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t0 48.52 40.88 16.11 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.243 2.217 . . . . 0.0 113.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.9 m120 67.77 22.96 8.7 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 127.797 2.439 . . . . 0.0 114.042 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 mtpp -130.55 152.8 49.53 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.166 0.986 . . . . 0.0 109.185 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.2 t -79.19 143.39 35.44 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.3 m-85 -147.19 161.08 41.64 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 122.727 0.411 . . . . 0.0 111.248 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -148.7 159.6 43.96 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.583 0.753 . . . . 0.0 109.453 178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.0 t -92.49 127.79 44.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.1 p -99.47 171.98 7.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.004 0.906 . . . . 0.0 110.91 -178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -76.36 -5.69 48.29 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 127.11 2.164 . . . . 0.0 113.1 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -81.46 104.14 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 124.327 1.051 . . . . 0.0 109.614 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -92.03 140.85 29.24 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 135.47 23.1 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.83 152.6 68.97 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.097 2.531 . . . . 0.0 111.205 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.37 -26.08 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 122.008 -0.432 . . . . 0.0 110.992 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -66.58 -19.5 65.79 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.59 -0.694 . . . . 0.0 112.044 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -96.55 -14.77 22.02 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.066 1.746 . . . . 0.0 111.028 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.3 t -67.5 139.11 21.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.06 -54.18 4.35 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.151 1.38 . . . . 0.0 110.807 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.06 169.33 6.61 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.314 1.446 . . . . 0.0 110.892 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.6 p -65.55 161.09 20.96 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.274 1.83 . . . . 0.0 109.466 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -130.62 -56.05 1.07 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.573 -1.203 . . . . 0.0 112.306 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.9 t -148.79 143.73 18.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 119.194 0.906 . . . . 0.0 111.444 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -121.96 109.28 14.41 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.967 1.307 . . . . 0.0 109.82 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -136.81 156.69 48.17 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 130.853 3.661 . . . . 0.0 105.723 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -117.7 114.94 24.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.576 1.08 . . . . 0.0 109.941 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -147.02 122.58 10.44 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.073 0.949 . . . . 0.0 109.556 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tt -135.76 141.34 44.81 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.943 2.097 . . . . 0.0 107.578 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -151.61 171.31 17.82 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.682 1.193 . . . . 0.0 109.725 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.2 mt -123.98 130.52 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.7 t -125.88 151.92 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.511 1.525 . . . . 0.0 107.238 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -101.52 126.58 48.35 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.2 1.364 . . . . 0.0 108.321 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.8 mtp -64.91 -21.19 66.77 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.793 1.633 . . . . 0.0 112.323 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -54.56 38.96 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 119.052 0.842 . . . . 0.0 112.795 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.2 m -112.62 -2.51 14.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.755 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 59.5 34.61 22.57 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.468 1.907 . . . . 0.0 111.162 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -111.82 156.75 21.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.494 0.717 . . . . 0.0 110.464 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.53 142.45 56.54 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.087 . . . . 0.0 110.12 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.3 mt -120.7 175.72 5.88 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.142 1.777 . . . . 0.0 110.787 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.2 m -116.2 3.67 13.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.586 2.355 . . . . 0.0 111.019 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.1 t -160.16 160.79 33.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 p -97.68 121.18 39.28 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.346 1.459 . . . . 0.0 107.679 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.65 168.29 15.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.382 1.073 . . . . 0.0 110.607 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -50.74 -41.84 56.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -77.74 -1.68 32.47 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.769 0.713 . . . . 0.0 111.535 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.6 t -112.77 163.5 14.51 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.804 1.642 . . . . 0.0 110.831 -178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.32 134.26 17.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 129.315 3.046 . . . . 0.0 104.935 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.49 144.23 28.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -127.24 145.44 50.78 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 7.7 t -120.43 104.14 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 103.141 -2.911 . . . . 0.0 103.141 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -98.23 93.76 6.41 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -169.17 -167.48 0.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 49.89 67.98 0.82 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.836 1.654 . . . . 0.0 113.123 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.6 mt -71.47 144.42 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.353 1.461 . . . . 0.0 111.952 -178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -137.36 169.46 17.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.373 2.669 . . . . 0.0 110.102 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -121.48 154.65 36.32 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 126.414 1.886 . . . . 0.0 108.136 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.88 166.97 10.51 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 125.753 1.621 . . . . 0.0 109.978 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m -62.17 -27.56 69.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.415 0.286 . . . . 0.0 111.054 178.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -84.35 15.42 3.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.834 1.254 . . . . 0.0 110.471 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.9 mmmm 66.57 4.44 3.34 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.9 1.68 . . . . 0.0 111.056 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.01 164.65 26.38 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 178.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.0 mt -116.66 155.22 29.19 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 109.145 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.3 p -147.81 166.75 26.63 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.89 0.476 . . . . 0.0 110.039 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 50.5 ttm -130.86 141.95 50.35 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 126.077 1.751 . . . . 0.0 110.249 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.27 121.82 5.66 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 125.49 1.519 . . . . 0.0 110.483 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.2 mt -140.77 116.72 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 104.451 -2.426 . . . . 0.0 104.451 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 53.44 51.13 15.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.81 0.844 . . . . 0.0 110.628 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 62.4 -2.89 0.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.389 2.676 . . . . 0.0 115.769 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -101.98 138.35 39.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.368 1.867 . . . . 0.0 108.581 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -96.21 116.48 29.07 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -105.8 127.86 53.36 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.873 1.669 . . . . 0.0 109.33 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -63.41 150.73 42.89 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.994 0.918 . . . . 0.0 110.152 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -119.3 133.68 65.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 179.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -126.07 161.24 52.82 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.388 1.075 . . . . 0.0 110.03 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.45 153.83 65.46 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.864 2.376 . . . . 0.0 109.611 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.2 pm0 -56.56 -22.83 36.1 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.491 0.716 . . . . 0.0 110.819 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.6 m -57.17 -22.65 41.93 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.903 1.681 . . . . 0.0 111.19 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -76.31 1.1 17.09 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.731 1.212 . . . . 0.0 113.2 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.75 143.21 37.54 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 120.968 -1.083 . . . . 0.0 110.61 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.82 -42.44 1.9 Allowed Glycine 0 CA--C 1.522 0.508 0 C-N-CA 125.806 1.669 . . . . 0.0 110.737 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.65 -16.1 13.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.587 1.193 . . . . 0.0 111.771 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.51 143.47 41.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -135.15 169.61 17.18 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.465 1.106 . . . . 0.0 108.929 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.9 158.37 30.83 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.509 0.671 . . . . 0.0 109.602 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.19 164.12 13.83 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.489 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -113.24 135.78 53.45 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.362 1.065 . . . . 0.0 110.032 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.44 ' H ' HD11 ' A' ' 107' ' ' LEU . 0.7 OUTLIER -65.43 -10.64 35.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.971 1.709 . . . . 0.0 111.386 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -60.29 -25.36 65.68 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.696 1.599 . . . . 0.0 111.47 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -72.79 -0.23 12.77 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.397 -177.914 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? . . . . . 0 C--O 1.235 0.301 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.61 153.49 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -120.69 122.02 39.54 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 102.865 -3.013 . . . . 0.0 102.865 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -105.71 -178.03 3.53 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 120.822 1.646 . . . . 0.0 112.633 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -56.95 -33.95 67.53 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 129.153 2.981 . . . . 0.0 115.15 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 38.34 70.71 0.19 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 127.911 2.484 . . . . 0.0 114.28 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.0 7.97 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 113.6 -1.636 . . . . 0.0 111.981 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 179.26 6.57 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.021 0.928 . . . . 0.0 110.533 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.1 -169.62 0.64 Allowed 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.9 p -78.29 122.07 25.25 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 119.467 -2.021 . . . . 0.0 110.559 -174.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -166.27 147.03 6.4 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 130.479 3.512 . . . . 0.0 105.938 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 36.5 p90 -167.0 172.76 9.88 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 125.439 1.495 . . . . 0.0 107.917 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.2 mt -134.95 121.94 35.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 O-C-N 120.537 -1.352 . . . . 0.0 108.669 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -132.62 137.36 46.99 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.136 1.374 . . . . 0.0 107.83 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.45 34.13 17.55 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.149 1.38 . . . . 0.0 112.915 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 71.52 9.79 6.44 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.131 2.572 . . . . 0.0 113.277 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -111.04 139.17 46.63 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 134.04 38.71 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.5 m-85 -137.28 166.63 23.33 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 125.037 1.335 . . . . 0.0 110.354 -178.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -149.21 170.47 18.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.3 t -105.04 123.42 59.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 p -92.81 169.51 10.41 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.91 1.684 . . . . 0.0 110.503 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -79.2 -10.16 59.75 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.258 1.423 . . . . 0.0 111.978 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.74 100.15 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.826 0.851 . . . . 0.0 109.039 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -86.49 147.21 26.08 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.76 137.43 24.31 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.99 1.316 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.83 147.47 75.04 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.729 2.286 . . . . 0.0 109.326 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -55.78 -32.96 63.93 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.387 0.675 . . . . 0.0 112.728 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -64.9 -21.88 66.89 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.954 0.901 . . . . 0.0 112.075 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -90.98 -19.76 22.87 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.489 -0.757 . . . . 0.0 110.432 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.9 t -70.3 129.55 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.12 -61.58 1.82 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.74 0.816 . . . . 0.0 110.529 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.12 169.67 21.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.483 0.583 . . . . 0.0 110.763 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.7 p -64.77 153.03 41.11 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.026 0.93 . . . . 0.0 109.327 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.4 ' HE3' HD11 ' A' ' 82' ' ' LEU . 8.6 ttmm -124.66 -50.36 1.74 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.2 t -149.71 140.69 16.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -106.84 121.08 43.68 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.802 1.241 . . . . 0.0 108.073 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -150.3 159.03 44.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.423 3.489 . . . . 0.0 105.85 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.45 107.39 5.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -138.36 129.8 27.6 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.5 tt -137.84 138.41 39.1 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.17 169.3 18.14 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 125.284 1.433 . . . . 0.0 107.343 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 65.7 mt -124.43 131.21 73.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.443 ' C ' ' HG ' ' A' ' 66' ' ' SER . 5.3 t -122.25 127.62 75.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 124.865 1.266 . . . . 0.0 110.837 -178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -74.63 100.16 3.86 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 126.794 2.038 . . . . 0.0 107.482 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 73.1 mtp -55.22 -29.14 57.38 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.488 0.585 . . . . 0.0 112.157 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.64 84.67 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 125.03 1.332 . . . . 0.0 113.556 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -121.85 -4.63 9.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.955 1.252 . . . . 0.0 112.216 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 63.26 34.57 13.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.769 2.028 . . . . 0.0 110.291 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -119.83 157.14 29.28 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.095 0.958 . . . . 0.0 110.937 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.44 151.41 44.02 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.022 0.529 . . . . 0.0 111.648 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.4 mt -134.84 174.49 10.53 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.726 2.01 . . . . 0.0 109.07 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 21.0 p -117.16 -5.31 11.37 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.707 1.603 . . . . 0.0 112.705 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 m -144.88 129.97 18.5 Favored 'General case' 0 CA--C 1.521 -0.166 0 O-C-N 120.001 -1.687 . . . . 0.0 107.7 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.59 122.48 23.99 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -127.77 170.7 12.46 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.937 2.095 . . . . 0.0 108.349 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.407 ' HA ' ' HE2' ' A' ' 64' ' ' LYS . 9.5 mmpt? -58.63 -13.13 5.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -104.9 8.64 34.71 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.827 1.194 . . . . 0.0 109.325 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.443 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -127.21 162.03 27.12 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.441 1.097 . . . . 0.0 112.793 -177.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -132.31 160.04 42.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 126.363 1.865 . . . . 0.0 108.251 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 t -105.72 142.7 34.99 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -134.24 120.46 20.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.49 103.22 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -91.85 93.01 8.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.05 -169.22 2.12 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.12 67.4 0.84 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.848 2.059 . . . . 0.0 113.183 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.8 mt -73.59 146.81 9.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 O-C-N 121.057 -1.027 . . . . 0.0 111.064 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -142.75 169.47 17.51 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 126.674 1.989 . . . . 0.0 111.191 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -114.53 158.11 22.09 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 127.307 2.243 . . . . 0.0 106.103 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.58 167.41 14.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.597 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.5 t -62.99 -23.5 67.47 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 122.979 0.512 . . . . 0.0 111.481 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -86.7 6.63 30.33 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 120.805 -1.185 . . . . 0.0 109.47 179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm 68.89 1.18 3.02 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.976 2.51 . . . . 0.0 111.056 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.5 m -73.81 154.97 39.3 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.4 HD11 ' HE3' ' A' ' 42' ' ' LYS . 1.2 mm? -108.71 152.88 24.23 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.161 0.984 . . . . 0.0 110.341 -178.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.6 p -141.2 177.38 8.12 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.088 0.47 . . . . 0.0 111.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.9 ttm -136.69 138.23 40.83 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 126.234 1.814 . . . . 0.0 109.398 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.65 118.44 4.67 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 107.522 -2.231 . . . . 0.0 107.522 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -135.03 123.35 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 49.95 45.13 25.38 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 123.789 0.681 . . . . 0.0 109.878 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 63.15 18.99 11.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.528 1.931 . . . . 0.0 114.836 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -124.46 144.78 49.89 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.173 0.989 . . . . 0.0 109.844 178.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -94.15 115.99 28.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.735 0.698 . . . . 0.0 112.047 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.81 124.07 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.205 1.402 . . . . 0.0 109.764 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -62.28 147.94 46.49 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.54 1.136 . . . . 0.0 111.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -115.95 134.33 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 123.887 0.875 . . . . 0.0 109.238 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -127.6 158.46 69.91 Favored Pre-proline 0 C--O 1.235 0.313 0 C-N-CA 124.671 1.189 . . . . 0.0 109.983 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -75.39 154.3 40.6 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.718 2.279 . . . . 0.0 110.811 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.94 -6.48 12.62 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.957 -0.465 . . . . 0.0 111.811 178.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.3 p -72.86 -14.55 61.52 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.488 -1.382 . . . . 0.0 110.451 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.21 -4.92 58.02 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 142.51 34.08 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.01 0.924 . . . . 0.0 111.208 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.53 -15.24 19.99 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 126.107 1.813 . . . . 0.0 111.079 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.43 -12.68 0.8 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.473 1.509 . . . . 0.0 111.95 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.1 150.24 31.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -141.57 162.74 34.74 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.103 1.361 . . . . 0.0 108.368 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.31 167.02 1.47 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.572 0.701 . . . . 0.0 112.884 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.16 161.25 13.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.693 0.759 . . . . 0.0 112.559 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.0 mmm-85 -109.24 117.26 33.65 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -6.02 16.77 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.369 0.418 . . . . 0.0 111.795 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -59.52 -23.49 62.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 110.491 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -69.14 -12.09 61.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.728 0.811 . . . . 0.0 112.554 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.943 1.697 . . . . 0.0 107.746 -178.526 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.468 0.442 0 CA-C-O 121.414 0.626 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.2 t -95.06 133.17 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 125.627 1.571 . . . . 0.0 107.997 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -95.52 122.16 37.97 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -89.38 161.56 16.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -68.98 -33.78 74.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.827 1.651 . . . . 0.0 111.602 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 46.68 99.18 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 127.291 2.236 . . . . 0.0 114.802 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.74 20.75 53.12 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.039 -1.437 . . . . 0.0 112.395 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.91 179.53 6.12 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.75 1.62 . . . . 0.0 111.661 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -169.94 0.98 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.056 2.142 . . . . 0.0 107.361 177.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.0 p -80.63 120.4 24.52 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 124.586 2.136 . . . . 0.0 111.681 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -168.58 153.54 6.24 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 130.941 3.696 . . . . 0.0 106.108 177.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -168.52 173.79 7.26 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.0 mt -132.92 120.19 40.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -130.58 138.13 50.0 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t0 55.57 35.22 24.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.601 1.56 . . . . 0.0 112.071 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 65.1 15.65 10.12 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 127.345 2.258 . . . . 0.0 112.842 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -118.66 142.1 47.98 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.9 m -75.63 142.83 42.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -139.8 162.57 34.82 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.076 1.751 . . . . 0.0 109.585 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -148.86 166.81 27.42 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.675 1.19 . . . . 0.0 109.129 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.1 t -97.33 128.64 48.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 C-N-CA 123.04 0.536 . . . . 0.0 109.599 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -97.0 170.25 9.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.129 0.972 . . . . 0.0 111.112 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -77.82 -14.43 59.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.962 1.305 . . . . 0.0 111.982 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -69.01 101.21 1.35 Allowed 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 125.264 1.426 . . . . 0.0 110.614 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.14 141.6 28.53 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -118.14 143.98 33.95 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.482 1.113 . . . . 0.0 108.389 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 154.93 58.9 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.304 3.336 . . . . 0.0 113.383 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -58.22 -33.34 69.21 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.124 0.97 . . . . 0.0 111.9 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -62.52 -23.16 66.8 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.748 0.819 . . . . 0.0 111.539 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -90.49 -22.84 21.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.184 0.594 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.98 119.3 6.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -77.5 -59.96 2.56 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.082 0.953 . . . . 0.0 110.223 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.37 20.11 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.511 0.725 . . . . 0.0 110.533 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -65.38 165.33 12.04 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.031 0.92 . . . . 0.0 108.724 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.89 -53.37 1.42 Allowed 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 120.785 -1.197 . . . . 0.0 108.631 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 t -140.86 145.4 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm -124.81 92.95 3.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.665 1.186 . . . . 0.0 108.566 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -137.32 155.31 49.59 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 128.962 2.905 . . . . 0.0 106.851 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -120.96 130.49 53.86 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.856 0.862 . . . . 0.0 111.844 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.418 ' HE2' ' CD2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -148.81 126.85 11.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.403 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.4 tt -131.25 145.06 51.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.179 2.592 . . . . 0.0 110.256 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.418 ' CD2' ' HE2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -152.3 171.04 18.6 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.588 1.955 . . . . 0.0 109.506 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.4 mt -128.34 127.77 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.187 1.395 . . . . 0.0 108.096 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 t -122.68 148.8 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.43 1.492 . . . . 0.0 109.131 -179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -92.83 125.98 37.7 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.185 1.394 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 75.6 mtp -67.87 -26.23 65.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.869 1.213 . . . . 0.0 110.605 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -63.04 -41.55 99.52 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.4 m -121.99 -1.61 9.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.588 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 60.98 27.28 17.17 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.953 1.301 . . . . 0.0 109.835 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.47 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 9.3 mmpt? -103.45 154.03 19.88 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.391 1.076 . . . . 0.0 110.84 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.65 155.11 41.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 89.6 mt -131.32 175.12 9.4 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.164 1.386 . . . . 0.0 109.726 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -113.94 -4.81 13.21 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.315 1.446 . . . . 0.0 110.68 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.6 p -152.41 154.06 34.82 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 120.393 1.452 . . . . 0.0 108.98 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -84.59 124.44 31.44 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -129.07 165.58 20.94 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.662 1.585 . . . . 0.0 108.392 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -56.08 -43.72 78.29 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.429 -0.794 . . . . 0.0 112.359 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -74.61 5.74 4.53 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.6 t -113.58 166.25 11.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.324 1.45 . . . . 0.0 111.034 -179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.8 t -143.48 123.8 9.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 126.704 2.002 . . . . 0.0 106.358 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.8 t -80.51 144.32 32.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.39 147.26 52.55 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.78 103.5 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -99.05 91.76 5.17 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -166.97 0.96 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -176.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 55.79 67.09 1.06 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.676 0.391 . . . . 0.0 111.716 176.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mt -77.36 138.16 20.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.569 0.747 . . . . 0.0 110.632 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.7 m-85 -137.45 169.65 17.42 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 127.175 2.19 . . . . 0.0 109.808 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -118.17 156.76 28.17 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.125 1.77 . . . . 0.0 108.283 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.01 171.05 7.77 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 126.031 1.732 . . . . 0.0 112.375 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.2 p -57.07 -37.0 71.22 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 127.309 2.244 . . . . 0.0 112.176 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -87.72 16.13 6.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.532 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 69.38 -1.34 2.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 126.821 2.049 . . . . 0.0 111.134 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.67 164.89 20.55 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.86 0.755 . . . . 0.0 109.614 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.09 144.9 41.84 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.829 1.252 . . . . 0.0 109.415 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.37 168.25 20.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.869 0.868 . . . . 0.0 109.52 178.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 38.4 ttm -134.07 143.24 47.91 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.948 1.699 . . . . 0.0 109.749 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.85 124.43 6.85 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 125.217 1.389 . . . . 0.0 110.43 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 57.0 mt -143.13 120.92 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 53.8 44.81 29.03 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.293 1.044 . . . . 0.0 109.607 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.13 14.6 3.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.706 2.802 . . . . 0.0 114.327 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -116.86 147.48 42.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.722 1.609 . . . . 0.0 107.198 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -98.9 116.52 31.33 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.931 0.892 . . . . 0.0 112.527 -177.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -108.49 128.26 54.65 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.683 1.593 . . . . 0.0 109.781 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.423 ' HE2' HD23 ' A' ' 94' ' ' LEU . 7.3 ttpt -65.75 151.0 47.6 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.413 -0.804 . . . . 0.0 110.164 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.56 134.29 63.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.423 HD23 ' HE2' ' A' ' 92' ' ' LYS . 4.3 mm? -122.32 157.91 57.29 Favored Pre-proline 0 C--O 1.233 0.237 0 C-N-CA 124.023 0.929 . . . . 0.0 110.119 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.59 155.71 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.377 2.052 . . . . 0.0 110.346 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.64 -9.2 25.08 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.375 -0.828 . . . . 0.0 110.557 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 m -70.82 -8.1 50.1 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.279 2.232 . . . . 0.0 110.72 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . 0.257 0.0 OUTLIER -114.49 3.15 14.83 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -51.28 161.09 0.47 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.866 1.266 . . . . 0.0 111.784 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.33 -42.54 3.11 Favored Glycine 0 CA--C 1.522 0.519 0 O-C-N 120.926 -1.109 . . . . 0.0 111.351 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.96 53.18 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.124 1.462 . . . . 0.0 108.983 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.5 147.94 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 C-N-CA 126.443 1.897 . . . . 0.0 108.622 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -114.15 167.44 10.68 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.027 1.331 . . . . 0.0 108.508 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.88 166.08 20.24 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.851 0.834 . . . . 0.0 109.317 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.41 157.95 15.71 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -110.45 139.46 45.65 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.005 0.922 . . . . 0.0 113.27 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.2 -28.15 69.18 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.976 1.71 . . . . 0.0 110.105 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -53.22 -30.31 37.23 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.006 1.722 . . . . 0.0 113.792 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -70.08 -11.29 60.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.432 0.693 . . . . 0.0 109.661 -177.22 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.674 -0.679 . . . . 0.0 109.735 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.7 t -71.19 145.49 12.52 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 CA-C-N 119.193 0.906 . . . . 0.0 109.224 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 -103.14 97.35 7.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.5 145.0 41.72 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.24 -25.44 63.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.701 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 66.78 142.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.671 2.389 . . . . 0.0 112.901 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.99 28.03 15.89 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.249 0.928 . . . . 0.0 112.928 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -137.28 177.89 7.51 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 125.305 1.442 . . . . 0.0 110.931 -178.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -74.79 -168.9 0.79 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 127.173 2.189 . . . . 0.0 107.701 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.251 7.7 p -79.61 120.21 23.63 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 120.43 -1.419 . . . . 0.0 107.248 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -168.18 148.21 4.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 131.649 3.98 . . . . 0.0 104.712 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -172.68 165.57 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 mm -117.87 135.9 56.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 122.027 0.918 . . . . 0.0 108.642 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -149.09 142.74 25.48 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.221 -1.809 . . . . 0.0 108.962 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t0 51.85 33.61 11.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.871 1.268 . . . . 0.0 110.863 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 55.57 29.12 12.9 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 127.573 2.349 . . . . 0.0 112.463 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -124.6 144.01 50.4 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 m -81.88 114.43 20.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -117.76 165.7 13.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.722 2.009 . . . . 0.0 111.879 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.463 ' CE2' HG22 ' A' ' 29' ' ' THR . 21.9 p90 -150.33 173.89 13.48 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.175 1.39 . . . . 0.0 109.576 178.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.49 128.55 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.463 HG22 ' CE2' ' A' ' 27' ' ' PHE . 43.9 p -90.02 163.88 14.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.943 1.297 . . . . 0.0 113.584 -178.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -75.74 -16.78 60.09 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.221 1.809 . . . . 0.0 112.737 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -75.18 136.94 41.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.602 1.561 . . . . 0.0 106.893 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.402 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 42.3 tt0 -118.9 147.32 44.12 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.708 1.603 . . . . 0.0 111.095 -178.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.46 136.88 24.24 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.605 1.562 . . . . 0.0 107.432 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.02 156.87 26.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 124.615 3.543 . . . . 0.0 112.136 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -57.95 -28.47 64.35 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.811 0.844 . . . . 0.0 111.737 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -67.13 -14.42 62.89 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.07 -1.019 . . . . 0.0 112.119 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -104.08 -8.31 19.6 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.609 1.164 . . . . 0.0 110.889 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.65 132.38 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.703 1.601 . . . . 0.0 108.668 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -83.63 -56.09 3.92 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.572 1.149 . . . . 0.0 110.445 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.08 170.09 9.04 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.713 1.605 . . . . 0.0 109.412 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.8 p -68.97 174.03 4.86 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.7 tttp -138.92 -39.02 0.5 Allowed 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.179 -0.951 . . . . 0.0 112.407 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -149.34 117.55 0.93 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.714 0.806 . . . . 0.0 109.043 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 124.22 33.48 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 104.322 -2.473 . . . . 0.0 104.322 176.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.69 157.18 42.66 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 128.417 2.687 . . . . 0.0 105.312 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -140.59 109.7 6.14 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.413 1.085 . . . . 0.0 110.332 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -144.18 139.72 28.92 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -137.28 144.74 42.84 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 127.696 2.398 . . . . 0.0 108.256 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -154.47 169.55 23.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 61.9 mt -131.07 134.02 62.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 t -122.88 143.11 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.468 1.107 . . . . 0.0 108.282 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.08 123.86 28.74 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 106.388 -1.708 . . . . 0.0 106.388 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtp -68.24 -21.85 64.81 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 120.287 1.403 . . . . 0.0 114.018 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -74.27 -53.57 9.48 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.856 0.753 . . . . 0.0 110.364 -179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.8 m -91.92 -15.87 27.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.54 30.76 19.99 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 126.545 1.938 . . . . 0.0 111.798 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -115.59 161.09 19.13 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.633 1.173 . . . . 0.0 109.257 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.34 149.45 44.39 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.193 0.52 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 mt -129.19 173.05 10.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.33 1.852 . . . . 0.0 107.786 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 t -118.66 12.72 13.16 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.255 1.022 . . . . 0.0 111.512 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.5 p -159.07 157.75 31.7 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.827 1.194 . . . . 0.0 109.28 -179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 t -89.7 119.91 30.51 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.948 0.899 . . . . 0.0 110.098 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -130.72 160.12 35.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.314 1.045 . . . . 0.0 109.473 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -51.8 -20.72 2.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -104.32 5.71 34.73 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.807 1.639 . . . . 0.0 111.161 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 21.1 m -115.55 165.74 12.67 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 124.95 1.3 . . . . 0.0 111.203 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.8 t -140.57 144.5 27.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 124.515 1.126 . . . . 0.0 108.259 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.1 t -87.48 143.37 27.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.761 1.224 . . . . 0.0 108.89 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.0 mt -136.78 122.88 20.34 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.9 t -104.88 103.29 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 103.556 -2.757 . . . . 0.0 103.556 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.02 97.48 10.74 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.94 -172.92 2.2 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.22 68.96 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.939 1.696 . . . . 0.0 114.79 177.123 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.8 mt -71.03 141.14 17.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.73 1.612 . . . . 0.0 109.223 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -131.44 169.43 16.06 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.171 1.788 . . . . 0.0 109.341 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -114.85 152.79 31.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.207 1.403 . . . . 0.0 107.546 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.09 160.74 14.59 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.947 1.299 . . . . 0.0 109.824 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -65.07 -24.68 67.53 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.238 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -85.7 12.85 8.04 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 126.588 1.955 . . . . 0.0 110.662 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 69.75 -1.82 2.19 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.917 2.087 . . . . 0.0 110.524 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.0 m -70.97 168.69 16.45 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.4 148.8 45.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.909 0.884 . . . . 0.0 111.177 -178.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 21.1 p -141.94 172.06 13.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.151 0.98 . . . . 0.0 111.019 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.4 ttm -133.05 139.71 47.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 126.121 1.768 . . . . 0.0 109.365 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.59 124.3 6.64 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.5 mt -141.98 123.03 12.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 49.27 44.89 23.61 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.573 1.149 . . . . 0.0 110.871 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.6 t0 67.11 4.27 3.54 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.961 2.905 . . . . 0.0 116.142 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -111.81 145.89 38.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.903 1.281 . . . . 0.0 108.907 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -98.86 117.91 34.43 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 123.034 0.534 . . . . 0.0 111.656 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.402 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 84.6 m-85 -105.95 132.15 52.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.685 1.194 . . . . 0.0 107.808 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -72.1 158.54 35.75 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 118.596 -1.242 . . . . 0.0 110.336 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.63 133.56 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -127.04 163.51 41.18 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 125.991 1.716 . . . . 0.0 110.736 -177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.76 143.3 26.6 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.296 1.997 . . . . 0.0 107.859 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -12.64 20.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.3 m -65.77 -13.81 60.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -76.1 -1.24 25.11 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.362 1.065 . . . . 0.0 112.382 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -50.46 149.77 2.96 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.506 1.122 . . . . 0.0 109.273 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.62 -42.33 2.91 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.45 -39.56 13.28 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.568 0.747 . . . . 0.0 108.986 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -130.44 170.79 18.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 125.798 1.639 . . . . 0.0 109.6 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -145.25 166.34 25.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.469 2.308 . . . . 0.0 108.186 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.42 174.24 5.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.445 0.641 . . . . 0.0 110.792 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.292 0.4 OUTLIER -68.99 176.17 3.3 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.134 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ptp85 -129.92 141.47 50.78 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 125.157 1.383 . . . . 0.0 112.229 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.0 mp -71.63 -17.95 62.23 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.248 0.619 . . . . 0.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -57.8 -26.53 62.08 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.082 1.753 . . . . 0.0 113.484 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -76.63 -9.43 58.66 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.772 0.829 . . . . 0.0 110.446 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 tptt . . . . . 0 N--CA 1.463 0.202 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.2 t -119.78 139.92 45.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 120.707 1.594 . . . . 0.0 108.798 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -107.18 118.41 36.65 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -84.66 175.42 9.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -80.84 -34.13 34.04 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 127.417 2.287 . . . . 0.0 110.459 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 54.13 127.64 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 128.465 2.706 . . . . 0.0 115.042 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.98 25.23 61.57 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.363 -0.836 . . . . 0.0 112.577 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 m -140.49 -179.62 6.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 126.95 2.1 . . . . 0.0 110.785 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -73.69 -171.06 0.96 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.491 1.516 . . . . 0.0 109.005 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.7 p -80.53 120.76 24.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 119.511 -1.993 . . . . 0.0 111.626 -175.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -167.16 154.9 9.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.44 3.896 . . . . 0.0 105.294 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 49.0 p90 -170.11 173.49 5.88 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.693 1.588 . . . . 0.0 107.437 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.1 mt -131.58 119.01 41.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 O-C-N 120.529 -1.357 . . . . 0.0 107.496 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -129.38 137.8 51.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.28 34.12 22.13 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.796 1.239 . . . . 0.0 111.438 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.7 m120 62.98 14.99 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.452 2.701 . . . . 0.0 112.931 -178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -111.62 132.94 54.22 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.8 m -76.32 129.06 36.08 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.0 m-85 -132.84 164.1 27.63 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 126.603 1.961 . . . . 0.0 110.516 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -149.25 159.37 44.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 109.442 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 t -89.72 132.23 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.4 p -102.04 166.3 10.69 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.732 1.213 . . . . 0.0 110.091 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.1 -7.69 55.32 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.342 1.057 . . . . 0.0 112.122 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -71.28 114.22 9.12 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -101.99 144.11 31.01 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.07 140.01 23.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.863 2.065 . . . . 0.0 108.403 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.77 156.15 39.56 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 123.016 2.477 . . . . 0.0 109.89 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.53 -29.47 69.14 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.12 -19.5 65.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.074 0.55 . . . . 0.0 111.936 179.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -93.17 -13.57 28.24 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.592 0.757 . . . . 0.0 110.28 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 65.7 t -75.2 123.5 31.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.24 -61.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.44 163.99 38.79 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.253 -0.904 . . . . 0.0 112.351 -178.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 m -65.5 137.26 57.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.601 1.56 . . . . 0.0 107.152 178.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HE3' ' OE2' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -112.29 -53.87 2.67 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.883 -177.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.1 t -141.01 134.39 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 119.814 1.188 . . . . 0.0 112.547 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.3 mtpt -103.53 110.21 22.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.05 156.75 44.1 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.445 2.698 . . . . 0.0 106.493 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -128.31 113.18 15.3 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.844 0.857 . . . . 0.0 110.723 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.88 134.41 18.63 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.954 0.797 . . . . 0.0 110.468 178.263 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.457 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 9.0 tt -138.32 145.04 40.69 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.85 1.66 . . . . 0.0 108.283 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.75 170.39 18.32 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.099 1.36 . . . . 0.0 107.402 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.9 mt -129.48 132.21 66.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.3 t -126.72 139.74 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.649 1.18 . . . . 0.0 109.458 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -85.99 128.36 34.83 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.309 -0.87 . . . . 0.0 109.406 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 46.9 mtp -68.64 -19.44 64.42 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttm -77.16 -46.85 22.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.519 1.509 . . . . 0.0 111.952 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.0 p -105.2 -6.06 20.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 63.88 18.81 11.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.695 1.198 . . . . 0.0 110.378 -179.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -101.72 159.91 14.91 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.342 0.974 . . . . 0.0 111.739 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.2 145.76 46.03 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.415 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 mt -126.6 166.32 17.53 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.893 2.077 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.83 -33.55 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.612 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.5 m -130.02 150.01 51.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.461 1.104 . . . . 0.0 109.551 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.92 111.09 17.79 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.495 0.718 . . . . 0.0 110.506 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -101.8 168.69 9.28 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 177.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -58.11 -32.66 68.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -78.53 -3.05 41.73 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.071 0.948 . . . . 0.0 110.445 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.4 t -114.58 161.66 17.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.393 1.477 . . . . 0.0 113.219 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.3 t -133.88 146.46 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 126.125 1.77 . . . . 0.0 108.431 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.29 144.19 29.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.966 1.306 . . . . 0.0 109.554 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.7 mt -135.37 122.53 21.53 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.865 -1.147 . . . . 0.0 108.162 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.5 t -106.71 103.41 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -99.36 96.64 7.85 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.124 -1.806 . . . . 0.0 106.124 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.22 -168.91 0.78 Allowed 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 50.06 68.31 0.77 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.88 1.272 . . . . 0.0 112.912 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.74 145.33 11.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.638 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -135.87 169.01 18.26 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.926 2.09 . . . . 0.0 109.064 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.42 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 tt0 -119.16 149.66 41.35 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.482 1.513 . . . . 0.0 107.071 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.56 166.58 10.64 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.593 1.557 . . . . 0.0 110.255 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.2 p -61.2 -29.95 70.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.911 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -101.58 29.47 4.85 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.995 1.718 . . . . 0.0 112.885 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 65.76 -0.82 1.19 Allowed 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.631 1.972 . . . . 0.0 114.055 178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -67.15 158.89 30.12 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.0 mt -115.62 144.43 43.91 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -138.76 164.88 28.44 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.8 ttm -127.7 137.35 52.45 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.317 1.847 . . . . 0.0 109.524 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.44 117.94 4.52 Favored Glycine 0 CA--C 1.521 0.438 0 C-N-CA 124.71 1.148 . . . . 0.0 110.393 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.8 mt -134.83 118.79 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 125.505 1.522 . . . . 0.0 107.101 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 49.94 47.21 23.56 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.481 1.113 . . . . 0.0 109.754 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 65.18 9.38 5.53 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.165 2.186 . . . . 0.0 114.733 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -115.48 136.95 52.56 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.164 1.386 . . . . 0.0 108.737 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -92.64 117.35 29.88 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.97 -0.456 . . . . 0.0 111.156 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 132.17 52.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.135 -0.978 . . . . 0.0 108.778 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 147.54 51.66 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -115.62 132.62 64.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -124.32 157.38 64.86 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 124.824 1.25 . . . . 0.0 108.775 -178.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.9 154.39 67.24 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.659 2.239 . . . . 0.0 109.685 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -61.04 -15.19 29.51 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.808 0.337 . . . . 0.0 111.631 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.3 p -80.05 -7.73 59.01 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 112.242 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -87.5 -9.58 54.14 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.696 1.598 . . . . 0.0 112.14 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.51 161.83 0.93 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.728 1.211 . . . . 0.0 113.492 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.78 -42.59 2.65 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 107.941 -2.064 . . . . 0.0 107.941 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.18 -27.62 22.92 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.194 0.998 . . . . 0.0 109.396 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.6 p -132.6 166.64 28.69 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.554 1.542 . . . . 0.0 109.882 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -135.94 165.19 26.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.841 2.456 . . . . 0.0 107.363 178.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.98 178.93 0.58 Allowed 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.452 0.644 . . . . 0.0 111.083 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.9 170.23 13.1 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.822 -0.549 . . . . 0.0 109.721 179.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -126.02 142.18 51.63 Favored 'General case' 0 CA--C 1.52 -0.199 0 O-C-N 121.166 -0.959 . . . . 0.0 110.11 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.4 -17.24 62.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.766 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.68 -18.07 61.74 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -73.15 -13.93 61.27 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.679 0.672 . . . . 0.0 111.784 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 C--O 1.248 0.988 0 C-N-CA 126.369 1.867 . . . . 0.0 110.342 -177.543 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.4 t -116.44 160.27 15.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.039 1.335 . . . . 0.0 108.608 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -128.46 107.69 9.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 102.821 -3.029 . . . . 0.0 102.821 178.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -82.36 166.63 19.29 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -33.98 76.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.158 0.89 . . . . 0.0 110.801 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 55.66 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.606 1.962 . . . . 0.0 113.424 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.51 7.3 51.71 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.819 1.199 . . . . 0.0 112.477 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 m -131.96 179.31 6.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.112 1.765 . . . . 0.0 110.031 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -73.4 -169.74 0.7 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.118 2.167 . . . . 0.0 107.778 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.0 p -80.71 120.31 24.44 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 120.068 -1.645 . . . . 0.0 111.708 -176.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -168.82 147.12 3.99 Favored 'General case' 0 CA--C 1.54 0.573 1 C-N-CA 133.622 4.769 . . . . 0.0 103.224 177.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 44.9 p90 -165.55 169.17 15.74 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 125.311 1.444 . . . . 0.0 107.83 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.5 mp -123.52 123.02 66.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 O-C-N 120.472 -1.393 . . . . 0.0 108.014 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -133.09 139.2 47.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t70 54.03 33.23 17.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.506 1.522 . . . . 0.0 112.626 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 65.27 24.02 12.19 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.33 1.452 . . . . 0.0 110.486 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -125.13 137.23 54.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.34 144.59 40.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.545 -2.021 . . . . 0.0 105.545 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.6 m-85 -147.99 167.45 24.88 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 127.032 2.133 . . . . 0.0 110.472 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -150.02 171.29 17.08 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.041 0.937 . . . . 0.0 108.761 177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.96 127.53 58.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -94.9 169.19 10.31 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.467 1.107 . . . . 0.0 110.472 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.24 -15.52 58.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.937 1.295 . . . . 0.0 112.817 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 111.96 6.38 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.333 0.653 . . . . 0.0 111.196 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -93.6 140.18 29.91 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.67 141.32 24.43 Favored Pre-proline 0 N--CA 1.466 0.358 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.65 151.47 41.45 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.7 1.6 . . . . 0.0 111.194 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -53.97 -29.06 41.3 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.737 1.615 . . . . 0.0 113.263 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -69.89 -29.09 66.2 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 123.289 0.636 . . . . 0.0 110.864 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.91 -15.57 44.03 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.797 0.839 . . . . 0.0 110.666 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.32 138.8 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.446 HD21 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -92.8 -61.57 1.56 Allowed 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.266 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.34 166.49 18.61 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.086 0.857 . . . . 0.0 112.245 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.7 m -63.69 138.76 58.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.599 1.16 . . . . 0.0 109.069 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -116.27 -36.34 4.07 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -148.76 142.8 18.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -117.83 102.34 9.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -135.67 157.81 45.94 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 130.419 3.488 . . . . 0.0 106.577 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -141.45 110.45 6.21 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.103 1.361 . . . . 0.0 107.608 179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -141.1 125.53 17.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 tt -125.34 144.39 50.52 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.555 1.542 . . . . 0.0 107.749 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -153.45 169.95 21.92 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 108.948 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.8 mt -124.29 138.41 53.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 125.613 1.565 . . . . 0.0 106.785 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.6 t -132.77 124.82 51.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.429 1.092 . . . . 0.0 109.977 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -62.19 121.65 13.62 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.664 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.3 mtp -68.2 -18.24 64.53 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 120.71 1.596 . . . . 0.0 112.546 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -84.18 -25.69 29.36 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -122.35 -13.43 8.06 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.273 0.629 . . . . 0.0 111.802 -178.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 63.65 21.27 12.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.605 1.562 . . . . 0.0 109.901 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -105.18 153.15 21.94 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.61 1.164 . . . . 0.0 110.783 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -67.34 148.22 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.958 0.903 . . . . 0.0 110.856 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.5 mt -136.04 177.28 7.96 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.004 1.722 . . . . 0.0 109.392 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.3 p -105.65 -30.36 9.53 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.144 1.377 . . . . 0.0 111.088 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -122.03 151.89 40.35 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.005 0.82 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -89.07 93.28 9.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.243 0.617 . . . . 0.0 109.551 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.69 164.39 18.63 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -57.33 -34.24 68.55 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -80.72 5.39 15.88 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.642 -0.661 . . . . 0.0 111.584 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.4 t -113.42 177.99 4.44 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.201 1.4 . . . . 0.0 111.634 -178.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 p -145.85 159.19 12.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 126.686 1.994 . . . . 0.0 107.419 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.23 143.14 42.46 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.0 mt -131.33 150.87 51.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 t -127.86 102.65 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -86.14 92.03 8.61 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.29 -173.02 3.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 47.3 67.63 0.77 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.874 1.67 . . . . 0.0 112.882 177.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mt -77.9 141.81 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 O-C-N 121.177 -0.952 . . . . 0.0 109.498 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -140.87 166.11 25.69 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.942 1.697 . . . . 0.0 110.039 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -110.9 158.04 19.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.918 2.087 . . . . 0.0 106.952 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.94 168.78 9.77 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.544 1.138 . . . . 0.0 112.27 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -58.06 -35.89 72.0 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.91 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -84.89 21.13 1.65 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.684 1.193 . . . . 0.0 111.785 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.8 mptt 59.1 19.68 7.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.306 1.443 . . . . 0.0 110.721 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.512 ' HB3' ' HE2' ' A' ' 92' ' ' LYS . 63.3 m -79.69 168.68 19.03 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mt -125.46 143.59 50.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.5 p -147.84 168.64 21.68 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.608 0.763 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.0 ttm -135.23 139.54 44.56 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.181 1.792 . . . . 0.0 109.733 -178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.1 6.98 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.9 mt -138.72 124.42 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 52.07 42.53 30.55 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.826 0.822 . . . . 0.0 109.004 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 60.44 20.86 10.52 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.834 2.054 . . . . 0.0 114.105 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 -122.07 137.66 54.73 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.712 1.605 . . . . 0.0 108.477 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -93.27 116.32 28.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -106.52 129.83 54.41 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.536 1.135 . . . . 0.0 110.754 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.512 ' HE2' ' HB3' ' A' ' 81' ' ' SER . 51.1 tttm -64.28 145.36 56.14 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.621 -0.674 . . . . 0.0 109.878 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.52 133.09 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -120.13 156.64 54.6 Favored Pre-proline 0 C--O 1.238 0.468 0 C-N-CA 124.128 0.971 . . . . 0.0 109.342 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.02 141.88 54.61 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 N-CA-C 106.726 -2.067 . . . . 0.0 106.726 179.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -22.1 37.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.673 -0.642 . . . . 0.0 111.668 -179.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 t -66.16 -13.17 59.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.129 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -3.16 43.56 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 120.563 1.529 . . . . 0.0 114.098 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -50.85 162.01 0.31 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.24 1.416 . . . . 0.0 113.794 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.84 -43.65 2.98 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 127.074 2.274 . . . . 0.0 110.969 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.89 -22.54 45.8 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -133.05 159.23 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 C-N-CA 130.78 3.632 . . . . 0.0 106.1 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -135.6 169.42 17.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 123.461 0.704 . . . . 0.0 109.953 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.84 160.29 17.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.71 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 158.6 8.72 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.937 0.875 . . . . 0.0 112.774 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 -109.94 119.24 38.7 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 124.744 1.217 . . . . 0.0 108.551 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -9.35 43.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.937 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.62 -22.12 66.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.452 1.101 . . . . 0.0 110.959 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -70.24 -9.04 54.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.646 1.178 . . . . 0.0 113.356 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 125.018 1.327 . . . . 0.0 110.178 -178.078 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.884 0.373 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -154.13 109.63 3.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.888 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.99 109.02 19.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.46 75.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.845 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -179.18 121.43 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -118.06 139.14 51.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.65 127.82 33.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.1 t -80.52 133.4 29.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -103.23 111.9 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -89.61 149.74 22.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -62.62 -34.97 78.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.845 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 65.27 138.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.89 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.69 25.47 9.17 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.479 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.29 -175.91 4.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.363 . . . . 0.0 110.847 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -165.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.2 p -75.67 116.75 16.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -171.54 153.46 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -174.9 158.1 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.886 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 84.8 mt -120.27 127.97 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -131.18 130.68 43.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t0 63.74 35.64 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.838 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 63.89 30.4 14.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.872 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -134.28 133.87 41.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -64.97 144.16 57.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.876 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -154.33 157.22 38.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -149.24 163.5 37.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.904 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.7 t -88.77 127.33 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.164 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.1 p -97.78 165.19 12.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.14 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -73.04 -17.41 61.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.853 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.72 126.61 28.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.857 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -110.24 140.39 44.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -113.13 134.4 21.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.59 0.709 . . . . 0.0 111.146 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 147.4 62.32 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.644 2.23 . . . . 0.0 112.388 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -54.89 -31.62 60.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.923 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -62.67 -21.95 66.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -93.41 -20.44 20.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -70.56 135.78 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.143 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -85.41 -57.34 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.67 178.33 3.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.0 p -55.76 161.22 2.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.3 tttm -131.85 -51.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.913 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.5 t -150.57 141.97 16.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.079 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -106.66 114.45 28.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -148.68 156.89 43.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -125.65 107.97 11.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -142.2 126.0 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.869 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 tt -138.08 138.98 39.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -152.18 169.39 22.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 21.4 mt -122.82 135.79 61.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.085 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -129.52 137.5 56.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.094 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -86.12 123.26 31.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.4 mtp -69.17 -9.95 55.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.06 -54.2 28.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.955 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -122.15 10.03 9.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 55.94 35.94 26.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -111.48 158.2 19.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.14 152.25 36.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.896 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 64.4 mt -129.84 -172.63 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.943 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -114.48 -16.13 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 p -134.78 176.85 8.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.2 t -107.57 108.55 19.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.8 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -107.8 173.43 6.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -67.87 -29.18 68.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-20 -91.48 13.25 18.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.4 t -130.98 158.32 40.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.6 t -133.58 135.76 55.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.5 t -77.96 140.45 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.114 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.4 mt -131.91 131.09 42.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 14.4 t -112.83 103.96 16.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.142 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.67 96.58 9.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.434 ' N ' HD21 ' A' ' 72' ' ' ASN . 0.1 OUTLIER -175.94 -168.9 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.868 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 68.01 0.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.3 mt -81.24 141.24 15.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.75 168.83 18.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -106.49 163.56 12.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.59 168.01 11.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.099 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -68.26 -27.61 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -95.61 26.6 3.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.888 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt 64.22 15.52 9.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.8 m -82.59 146.46 29.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.834 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.5 149.64 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 20.7 p -151.14 162.72 40.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.4 ttm -126.14 150.06 48.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.822 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -87.29 128.24 8.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.507 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.7 mt -146.2 111.86 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.811 0.338 . . . . 0.0 111.115 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 59.17 47.52 11.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 63.7 16.25 9.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -127.44 124.15 37.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -85.72 117.54 24.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -109.14 130.7 55.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.34 48.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.905 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.7 pt -118.24 133.5 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.105 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.16 159.46 64.94 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.622 0.725 . . . . 0.0 110.947 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 148.87 65.99 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 0.0 112.361 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -59.93 -20.14 55.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 49.5 m -69.23 -17.28 63.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -0.43 41.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -51.17 165.97 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 96.93 -41.47 2.34 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.5 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.41 -21.31 11.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.865 0.364 . . . . 0.0 111.116 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.13 146.68 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.163 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -129.45 166.33 19.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.947 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.48 168.02 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.095 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.52 164.89 20.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 21.4 mtt85 -111.93 139.41 47.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.883 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.65 -14.83 62.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.921 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -62.22 -17.06 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -78.78 -2.95 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.997 ' C ' ' O ' ' A' ' 110' ' ' PHE . 22.5 m-85 . . . . . 1 C--O 2.0 40.583 1 CA-C-O 161.141 19.543 . . . . 0.0 110.877 179.99 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -119.94 141.9 49.22 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . 0.263 23.8 p 58.45 7.34 0.69 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.848 2.859 . . . . 0.0 113.622 -179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 m -65.6 -0.48 2.06 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.558 2.743 . . . . 0.0 115.346 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -138.83 129.69 26.44 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.949 1.249 . . . . 0.0 107.705 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -148.46 179.13 8.03 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 126.206 1.802 . . . . 0.0 108.107 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -70.96 161.33 31.28 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 t -129.61 140.15 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 105.785 -1.932 . . . . 0.0 105.785 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -103.3 118.26 36.36 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.22 146.08 24.59 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -62.35 -34.87 77.51 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 64.28 133.59 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.702 2.001 . . . . 0.0 111.846 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.51 19.59 58.05 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.073 -1.017 . . . . 0.0 112.1 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.11 178.07 7.35 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.855 2.062 . . . . 0.0 109.983 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -169.56 0.78 Allowed 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.372 2.269 . . . . 0.0 107.771 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.2 p -79.96 120.74 24.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.378 -1.451 . . . . 0.0 107.743 -176.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -167.66 138.85 2.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.399 3.08 . . . . 0.0 106.117 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.401 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 35.9 p90 -162.15 177.94 9.23 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 123.561 0.744 . . . . 0.0 109.749 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 mt -137.93 122.92 23.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 C-N-CA 123.624 0.77 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 71.6 t80 -131.65 142.94 49.97 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 23.4 t70 56.32 34.31 23.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.809 1.244 . . . . 0.0 108.852 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 m120 62.35 12.05 4.98 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.254 2.222 . . . . 0.0 112.289 -178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.36 146.47 39.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 119.223 0.92 . . . . 0.0 109.235 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.1 m -75.38 133.48 41.18 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.302 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.401 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.6 m-85 -141.84 162.09 36.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.611 1.565 . . . . 0.0 109.123 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -148.56 161.73 41.08 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 121.031 -1.043 . . . . 0.0 108.619 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.79 130.76 40.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -100.19 169.83 8.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.128 0.971 . . . . 0.0 111.385 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.76 -14.63 61.15 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 126.935 2.094 . . . . 0.0 111.797 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -69.91 124.36 23.83 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 124.801 1.24 . . . . 0.0 109.693 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.32 144.74 40.02 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -123.74 138.7 30.85 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.384 1.474 . . . . 0.0 107.807 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.33 153.51 50.72 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.392 2.061 . . . . 0.0 112.646 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -50.39 -33.84 22.1 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 126.298 1.839 . . . . 0.0 114.45 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.484 ' HG3' HD21 ' A' ' 37' ' ' ASN . 5.8 pt-20 -67.82 -27.56 66.83 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.344 0.658 . . . . 0.0 111.625 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.484 HD21 ' HG3' ' A' ' 36' ' ' GLU . 1.9 m-80 -82.45 -24.76 34.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -67.13 119.51 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -74.21 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.58 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.62 172.37 15.48 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.06 0.544 . . . . 0.0 111.2 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.1 t -60.74 157.86 13.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.411 1.484 . . . . 0.0 108.722 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.503 ' HE2' ' CD1' ' A' ' 82' ' ' LEU . 3.7 tttp -133.43 -51.22 0.87 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 117.498 -1.239 . . . . 0.0 111.299 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -144.28 112.05 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.258 0.936 . . . . 0.0 111.408 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -84.41 92.62 8.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.41 156.65 38.5 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 130.019 3.328 . . . . 0.0 105.981 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -135.93 121.63 19.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.714 1.605 . . . . 0.0 110.145 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -147.45 132.77 18.5 Favored 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tt -134.45 143.23 47.41 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 126.924 2.09 . . . . 0.0 106.249 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -157.61 167.56 29.79 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.747 1.619 . . . . 0.0 107.695 178.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.5 mt -126.62 127.42 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.0 t -112.48 139.85 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.069 1.347 . . . . 0.0 109.584 -179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -87.01 120.86 28.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.153 1.381 . . . . 0.0 108.507 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.6 mtp -64.72 -21.07 66.67 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -77.01 -53.49 7.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 120.967 1.712 . . . . 0.0 111.937 -179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.5 m -96.9 -6.51 35.58 Favored 'General case' 0 CA--C 1.523 -0.072 0 CA-C-O 118.097 -0.954 . . . . 0.0 113.394 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 65.15 21.9 12.2 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -101.22 157.43 16.78 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 124.823 1.249 . . . . 0.0 111.088 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.82 152.83 33.26 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 69.0 mt -127.21 169.09 13.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.128 0.971 . . . . 0.0 109.814 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.2 p -109.99 11.56 23.96 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 126.988 2.115 . . . . 0.0 108.991 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.3 p -155.0 169.23 24.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.045 1.338 . . . . 0.0 111.714 -179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.8 t -101.62 110.84 22.91 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -117.64 157.2 26.85 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.573 0.749 . . . . 0.0 109.206 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -32.25 69.94 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.628 1.558 . . . . 0.0 113.704 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -85.02 15.43 4.07 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.353 1.061 . . . . 0.0 109.896 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 p -120.88 162.85 19.12 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.676 1.19 . . . . 0.0 110.55 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.5 t -137.77 130.63 41.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.3 t -80.25 134.09 36.06 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 106.039 -1.838 . . . . 0.0 106.039 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.3 125.51 43.63 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 t -104.69 103.01 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 102.879 -3.008 . . . . 0.0 102.879 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -96.34 91.86 6.05 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -168.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -175.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 48.07 67.17 0.88 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.825 1.25 . . . . 0.0 111.598 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -72.02 144.9 12.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.932 1.293 . . . . 0.0 111.697 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -138.25 169.25 18.12 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.295 2.238 . . . . 0.0 110.403 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -117.15 162.71 17.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.123 2.169 . . . . 0.0 108.139 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.15 175.41 6.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.396 1.878 . . . . 0.0 111.358 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -53.27 -48.04 68.63 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.03 1.732 . . . . 0.0 111.754 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -85.48 18.86 2.56 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.083 -1.01 . . . . 0.0 111.936 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.11 8.91 5.98 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.534 1.933 . . . . 0.0 109.723 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -64.52 157.03 27.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.503 ' CD1' ' HE2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -116.17 155.28 28.54 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.334 -0.854 . . . . 0.0 111.361 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.9 p -151.54 168.89 23.51 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.6 ttm -135.98 143.65 44.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.724 1.609 . . . . 0.0 109.737 -178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.73 125.37 7.03 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 109.796 -1.321 . . . . 0.0 109.796 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mt -143.38 121.73 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 50.84 35.72 12.92 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.574 0.75 . . . . 0.0 111.084 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 74.63 12.51 3.75 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 126.17 1.788 . . . . 0.0 114.31 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -120.04 135.64 54.86 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.639 1.175 . . . . 0.0 109.006 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -88.86 115.83 26.7 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.476 0.711 . . . . 0.0 110.591 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -109.18 131.54 54.97 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.517 1.127 . . . . 0.0 111.247 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -65.77 148.74 51.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.977 0.911 . . . . 0.0 110.31 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.3 pt -117.65 133.04 65.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -121.61 159.72 49.45 Favored Pre-proline 0 N--CA 1.467 0.405 0 C-N-CA 125.575 1.55 . . . . 0.0 109.21 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -71.98 151.36 56.13 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.07 1.847 . . . . 0.0 109.022 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.01 -5.68 5.01 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 p -80.16 -23.68 40.9 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.133 1.373 . . . . 0.0 111.181 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -72.31 -0.26 11.8 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.305 1.842 . . . . 0.0 114.539 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.1 mmtt -51.85 157.09 1.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.976 1.311 . . . . 0.0 111.272 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.1 -26.37 17.41 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.465 1.031 . . . . 0.0 111.483 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.03 -12.44 11.97 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.15 1.38 . . . . 0.0 110.149 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.8 p -150.26 150.27 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 C-N-CA 124.743 1.217 . . . . 0.0 108.127 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -129.82 173.0 11.08 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.895 2.478 . . . . 0.0 105.336 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 166.35 5.38 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.867 0.841 . . . . 0.0 111.043 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.58 162.48 8.25 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.012 0.925 . . . . 0.0 110.162 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.5 138.82 47.52 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.445 0.698 . . . . 0.0 112.169 -178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.61 -16.4 62.83 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.172 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -67.61 -3.82 10.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.637 1.175 . . . . 0.0 112.855 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -90.73 4.2 52.21 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 120.858 -1.152 . . . . 0.0 110.251 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 126.437 1.895 . . . . 0.0 107.994 -178.803 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -156.44 138.29 14.33 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.227 -0.921 . . . . 0.0 109.105 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.61 137.47 26.73 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.247 1.419 . . . . 0.0 108.87 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.6 p -156.44 164.37 38.33 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.38 -0.825 . . . . 0.0 111.52 -179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -151.24 127.39 10.51 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 126.639 1.976 . . . . 0.0 111.892 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -156.79 158.54 37.01 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.115 1.766 . . . . 0.0 107.608 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -63.75 150.83 43.67 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 t -107.32 136.98 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.7 119.12 38.46 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 106.147 -1.798 . . . . 0.0 106.147 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -93.54 172.21 8.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.871 1.268 . . . . 0.0 110.125 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -65.02 -25.4 67.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 128.39 2.676 . . . . 0.0 114.695 178.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 45.12 92.96 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.919 2.087 . . . . 0.0 114.264 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 31.55 50.52 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 113.325 -1.761 . . . . 0.0 113.18 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -136.01 -178.96 5.38 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 127.392 2.277 . . . . 0.0 110.434 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.99 -170.99 0.8 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.873 1.269 . . . . 0.0 108.404 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -79.13 120.44 23.66 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.783 -1.823 . . . . 0.0 110.274 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -168.99 145.47 3.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.014 2.926 . . . . 0.0 107.421 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 45.4 p90 -165.15 166.42 19.03 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mp -123.16 121.87 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 120.886 -1.134 . . . . 0.0 108.715 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -131.82 140.31 49.11 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 55.23 36.69 27.56 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.29 1.036 . . . . 0.0 110.72 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 m120 59.49 18.91 7.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.886 1.674 . . . . 0.0 112.753 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.95 140.01 50.7 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 126.273 1.829 . . . . 0.0 106.148 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 m -80.0 140.51 36.56 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.5 m-85 -140.83 162.83 34.5 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.479 1.912 . . . . 0.0 110.72 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.44 ' CD1' ' HE2' ' A' ' 99' ' ' LYS . 47.6 p90 -149.46 159.78 44.01 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.9 1.28 . . . . 0.0 109.64 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.5 t -89.06 133.47 31.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -99.67 169.95 8.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.206 1.003 . . . . 0.0 111.454 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -71.95 -21.01 61.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.64 2.776 . . . . 0.0 112.751 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 126.45 30.75 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.336 1.454 . . . . 0.0 112.711 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -99.31 147.68 24.94 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.82 2.048 . . . . 0.0 109.418 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.2 mp -114.3 127.41 26.85 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.26 148.1 79.62 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 121.57 1.513 . . . . 0.0 110.666 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.74 -27.22 49.45 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -72.02 -19.79 61.8 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.441 0.696 . . . . 0.0 111.94 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -90.55 -21.66 21.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.72 -0.612 . . . . 0.0 110.102 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 82.5 t -59.49 137.26 22.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 124.905 1.282 . . . . 0.0 107.736 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.431 ' ND2' HD21 ' A' ' 40' ' ' ASN . 0.1 OUTLIER -91.12 -61.66 1.61 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 118.538 -0.744 . . . . 0.0 109.16 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.431 HD21 ' ND2' ' A' ' 39' ' ' ASN . 5.6 p30 -161.29 167.56 25.67 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.049 0.84 . . . . 0.0 112.057 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.9 m -69.4 133.79 48.22 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.769 1.228 . . . . 0.0 108.741 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -57.02 2.09 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 117.697 -1.145 . . . . 0.0 111.902 -178.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.1 t -141.0 121.99 13.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -84.98 117.6 24.06 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 105.025 -2.213 . . . . 0.0 105.025 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.19 159.74 43.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 128.584 2.754 . . . . 0.0 109.541 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -141.33 121.4 13.74 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.112 -0.992 . . . . 0.0 108.908 177.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -148.14 137.44 22.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -134.93 143.29 46.82 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.775 2.03 . . . . 0.0 108.211 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -155.69 170.0 23.04 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.439 1.496 . . . . 0.0 109.539 177.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 mt -129.46 129.76 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.452 ' C ' ' HG ' ' A' ' 66' ' ' SER . 25.3 t -128.36 134.04 65.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.473 1.109 . . . . 0.0 111.04 -178.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -71.13 117.52 12.75 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 128.12 2.568 . . . . 0.0 108.06 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.6 mtp -67.83 -23.27 65.15 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.833 1.197 . . . . 0.0 113.314 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -69.61 -53.37 19.15 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.972 0.805 . . . . 0.0 110.21 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.1 m -106.78 -2.93 20.98 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 117.07 2.248 . . . . 0.0 117.07 -177.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 59.05 35.08 23.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.823 1.249 . . . . 0.0 112.128 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -116.73 148.37 41.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.482 1.113 . . . . 0.0 109.289 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.7 155.05 40.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 79.1 mt -131.3 170.59 14.4 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 109.807 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.4 p -92.36 -27.48 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.669 1.187 . . . . 0.0 112.714 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.0 m -135.83 163.33 30.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.06 1.344 . . . . 0.0 110.392 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -88.11 109.74 20.11 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.453 1.501 . . . . 0.0 110.166 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -119.09 157.95 26.83 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -55.81 -18.75 9.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -92.04 7.8 40.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 119.538 1.063 . . . . 0.0 110.356 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.452 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 15.1 t -133.83 166.89 21.61 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.473 1.909 . . . . 0.0 111.041 -177.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -142.2 156.21 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.99 1.716 . . . . 0.0 107.878 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.2 t -105.69 143.9 33.19 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.27 1.428 . . . . 0.0 108.577 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.44 133.69 44.17 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.0 t -104.52 102.3 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 103.846 -2.65 . . . . 0.0 103.846 178.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -82.83 95.62 7.97 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.55 -173.42 3.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 47.27 68.77 0.59 Allowed 'General case' 0 C--N 1.342 0.248 0 C-N-CA 127.694 2.398 . . . . 0.0 112.705 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.5 mt -72.45 140.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -134.64 170.27 16.05 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 127.284 2.233 . . . . 0.0 109.218 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.65 152.62 34.82 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 126.077 1.751 . . . . 0.0 108.079 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.8 165.57 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.965 1.706 . . . . 0.0 109.216 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.2 t -61.56 -24.77 66.88 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.896 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -81.88 7.93 11.63 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.577 2.351 . . . . 0.0 110.042 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt 68.84 -0.8 2.24 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.32 2.248 . . . . 0.0 109.794 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.1 t -75.16 168.57 19.73 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -114.81 156.18 25.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.401 1.081 . . . . 0.0 111.853 -178.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.3 p -145.8 166.48 25.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.842 0.857 . . . . 0.0 110.384 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 52.9 ttm -132.52 140.15 48.2 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.889 1.676 . . . . 0.0 109.285 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.15 110.23 3.31 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 124.884 1.23 . . . . 0.0 112.838 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.8 mt -130.55 124.37 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 49.59 53.67 12.33 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.436 2.294 . . . . 0.0 109.233 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 59.95 11.8 2.79 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.861 2.065 . . . . 0.0 114.825 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -119.43 132.89 55.9 Favored 'General case' 0 CA--C 1.514 -0.405 0 O-C-N 120.95 -1.094 . . . . 0.0 109.715 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -86.17 115.82 23.98 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -108.44 132.2 54.02 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.179 0.992 . . . . 0.0 110.56 -178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.9 ttpt -65.26 151.17 46.85 Favored 'General case' 0 C--O 1.238 0.449 0 O-C-N 122.053 -0.405 . . . . 0.0 111.023 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pt -117.25 133.22 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.26 157.7 55.11 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 125.274 1.43 . . . . 0.0 109.208 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.27 153.78 56.43 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.031 3.154 . . . . 0.0 110.846 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.57 -17.93 57.08 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.111 0.564 . . . . 0.0 111.544 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.9 m -77.0 -20.73 55.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.057 -0.497 . . . . 0.0 111.993 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.77 -0.16 41.85 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.901 0.773 . . . . 0.0 110.737 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' HE2' ' CD1' ' A' ' 27' ' ' PHE . 61.7 mmtt -59.98 150.75 28.07 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 102.09 -31.9 8.16 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 109.136 -1.585 . . . . 0.0 109.136 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.2 -19.36 14.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.93 1.692 . . . . 0.0 110.167 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.79 154.16 10.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 127.407 2.283 . . . . 0.0 106.854 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -131.34 170.87 14.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.718 1.607 . . . . 0.0 108.622 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.43 165.2 14.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.9 168.4 13.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -113.25 140.23 48.14 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 125.159 1.384 . . . . 0.0 109.454 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.47 -13.2 61.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -56.93 -26.72 59.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.949 0.9 . . . . 0.0 111.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -64.38 -19.65 65.62 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.197 1.399 . . . . 0.0 112.821 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.375 1.87 . . . . 0.0 111.646 -177.012 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 16.4 t80 . . . . . 0 CA--C 1.533 0.289 0 CA-C-O 121.13 0.491 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.2 mm-40 -155.84 69.67 0.68 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.0 p -143.92 163.83 32.3 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.799 0.84 . . . . 0.0 110.162 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 p -115.61 -61.42 1.74 Allowed 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.025 1.33 . . . . 0.0 109.13 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -71.63 -37.21 70.91 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt 52.22 43.75 30.35 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.068 1.347 . . . . 0.0 109.945 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -48.81 138.79 10.72 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.933 0.893 . . . . 0.0 111.047 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -90.55 118.7 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -84.59 100.65 11.56 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.42 138.94 40.68 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -64.95 -34.67 78.96 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 115.351 1.611 . . . . 0.0 115.351 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 57.86 139.86 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.899 2.079 . . . . 0.0 114.751 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.36 15.87 52.97 Favored Glycine 0 CA--C 1.534 1.273 0 O-C-N 121.156 -0.965 . . . . 0.0 111.965 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.11 177.33 7.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 127.644 2.378 . . . . 0.0 108.914 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -167.31 0.49 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 131.038 3.735 . . . . 0.0 109.24 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.285 24.2 p -78.76 119.07 21.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 123.771 1.748 . . . . 0.0 106.985 -176.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.13 139.75 2.87 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 130.974 3.71 . . . . 0.0 107.676 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -162.6 156.75 21.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 128.116 2.566 . . . . 0.0 107.08 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.2 mp -118.92 126.24 75.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 123.618 0.767 . . . . 0.0 108.971 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -131.5 138.66 49.06 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.291 1.036 . . . . 0.0 110.046 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.9 t70 54.05 34.16 19.24 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.343 1.857 . . . . 0.0 113.071 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 66.02 31.48 9.03 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 0.0 110.923 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -134.62 127.66 31.62 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 126.168 1.787 . . . . 0.0 106.641 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.6 m -76.16 132.11 39.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.95 172.59 9.27 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 127.951 2.5 . . . . 0.0 111.797 -177.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.316 25.9 p90 -153.19 144.79 23.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 129.486 3.114 . . . . 0.0 113.63 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.3 t -82.52 133.84 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.6 p -103.57 167.88 9.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.694 1.198 . . . . 0.0 110.107 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -72.14 -12.0 61.0 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.895 1.678 . . . . 0.0 113.201 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 111.44 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.911 1.284 . . . . 0.0 113.238 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 57.7 tt0 -89.92 146.71 24.2 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.424 1.49 . . . . 0.0 109.29 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.68 140.04 24.84 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.697 1.599 . . . . 0.0 107.929 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.81 150.35 61.69 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.817 . . . . 0.0 110.672 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -61.37 -19.42 61.84 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.51 -21.44 60.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.375 0.67 . . . . 0.0 110.588 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.69 -20.04 26.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.836 0.454 . . . . 0.0 111.554 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.0 t -61.3 130.45 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -89.87 -57.96 2.68 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.505 1.122 . . . . 0.0 110.5 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -164.05 172.33 13.96 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.079 0.952 . . . . 0.0 110.514 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.8 p -68.16 162.7 24.25 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -137.28 -45.07 0.56 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.33 122.81 2.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 118.598 0.635 . . . . 0.0 112.069 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -99.9 112.13 24.41 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -150.05 156.45 41.69 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 129.302 3.041 . . . . 0.0 104.893 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -131.8 119.36 21.15 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.443 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -148.12 135.12 20.21 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.443 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.1 tt -137.88 138.18 38.81 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 127.238 2.215 . . . . 0.0 109.147 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -144.42 169.65 17.53 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.991 0.916 . . . . 0.0 110.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.59 128.29 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.042 1.337 . . . . 0.0 107.957 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.67 134.68 65.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 124.799 1.24 . . . . 0.0 108.839 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -76.92 124.24 27.47 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 54.4 mtp -68.79 -29.76 68.18 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 120.255 -1.528 . . . . 0.0 112.887 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -79.48 -53.33 6.99 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.526 0.73 . . . . 0.0 110.784 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -81.48 -17.03 50.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.95 -1.024 . . . . 0.0 111.76 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 59.87 37.44 21.69 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.28 0.945 . . . . 0.0 109.664 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -129.42 161.38 30.5 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.411 1.084 . . . . 0.0 112.392 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.47 147.08 40.13 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.119 0.887 . . . . 0.0 110.061 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.764 ' CD1' ' HG ' ' A' ' 66' ' ' SER . 81.8 mt -131.54 170.49 14.65 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.801 1.24 . . . . 0.0 112.112 -178.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.83 -44.8 8.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.1 161.12 22.3 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.217 1.007 . . . . 0.0 112.665 -177.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.8 p -80.71 96.59 6.96 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -77.23 168.21 20.44 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 105.585 -2.006 . . . . 0.0 105.585 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -69.95 -23.32 63.17 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -80.93 2.95 24.52 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.764 ' HG ' ' CD1' ' A' ' 59' ' ' LEU . 2.5 m -119.28 161.0 21.15 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.653 1.181 . . . . 0.0 112.581 -177.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 55.9 t -136.66 154.95 32.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 126.501 1.92 . . . . 0.0 106.144 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.65 143.47 37.67 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -125.54 145.52 50.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -116.46 103.06 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -101.81 94.54 5.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.97 -173.35 2.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.176 -177.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 51.35 68.09 0.85 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.058 0.943 . . . . 0.0 113.241 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mt -74.68 143.86 12.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 124.903 1.281 . . . . 0.0 109.155 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -136.64 170.22 16.42 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.381 2.272 . . . . 0.0 109.868 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -116.97 157.77 25.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 126.316 1.846 . . . . 0.0 107.699 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.29 165.47 15.43 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.38 1.472 . . . . 0.0 111.463 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.5 t -56.08 -36.32 67.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.587 1.555 . . . . 0.0 111.326 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -87.99 17.93 4.59 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.667 0.787 . . . . 0.0 110.969 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt 67.61 3.25 3.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.372 1.869 . . . . 0.0 111.914 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.0 m -68.63 154.87 41.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.2 mt -114.63 147.58 39.35 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.4 p -142.52 169.08 18.25 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.734 0.414 . . . . 0.0 110.987 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 tpp -128.79 140.15 51.85 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.085 2.154 . . . . 0.0 108.464 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -88.27 115.63 4.43 Favored Glycine 0 N--CA 1.462 0.391 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.403 HG21 HD21 ' A' ' 87' ' ' ASN . 45.5 mt -132.09 119.98 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.403 HD21 HG21 ' A' ' 86' ' ' ILE . 9.7 m-80 50.5 47.09 24.65 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 122.1 0.953 . . . . 0.0 111.139 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 62.7 9.94 3.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 128.69 2.796 . . . . 0.0 113.672 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -112.08 125.3 53.95 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.613 1.565 . . . . 0.0 107.989 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -86.14 116.03 24.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.43 132.11 54.1 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.573 1.149 . . . . 0.0 109.402 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -63.61 155.46 29.62 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.465 0.706 . . . . 0.0 112.632 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -124.62 132.69 70.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.29 160.05 59.57 Favored Pre-proline 0 N--CA 1.474 0.767 0 C-N-CA 126.026 1.73 . . . . 0.0 110.248 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.52 152.32 78.62 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 109.835 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -60.64 -14.82 22.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.56 -0.257 . . . . 0.0 111.666 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.92 -13.64 62.55 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.283 -0.886 . . . . 0.0 110.953 177.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -2.75 40.53 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.829 1.195 . . . . 0.0 111.277 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp -52.47 152.16 3.72 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 120.846 -1.159 . . . . 0.0 110.954 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.68 -42.34 3.04 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -95.65 -14.0 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.211 1.506 . . . . 0.0 110.9 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 20.0 t -143.13 155.06 16.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 C-N-CA 126.818 2.047 . . . . 0.0 106.996 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -133.75 162.38 32.12 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.208 1.003 . . . . 0.0 109.08 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.33 159.7 26.19 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 165.09 13.56 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -125.27 140.34 52.92 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.455 ' CD1' ' H ' ' A' ' 107' ' ' LEU . 0.0 OUTLIER -65.04 -12.85 55.13 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 126.369 1.868 . . . . 0.0 112.692 179.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.31 -16.68 48.31 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.417 1.008 . . . . 0.0 112.15 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -81.49 -5.02 57.53 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 110.981 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.873 2.069 . . . . 0.0 107.045 -179.705 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.45 160.3 16.58 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.469 1.908 . . . . 0.0 111.26 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -130.0 25.71 5.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.919 1.288 . . . . 0.0 113.797 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 t 56.51 17.89 3.25 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 120.887 -1.133 . . . . 0.0 113.625 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 56.73 32.39 21.1 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.353 1.461 . . . . 0.0 113.245 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -127.86 159.04 36.13 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.602 1.561 . . . . 0.0 109.113 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.25 171.97 13.02 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.956 1.303 . . . . 0.0 109.488 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.2 t -124.45 144.16 35.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 124.414 1.086 . . . . 0.0 110.26 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -112.56 138.13 49.8 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -113.41 152.17 30.4 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.69 -25.84 68.12 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.659 0.784 . . . . 0.0 111.622 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.8 137.99 0.03 OUTLIER 'General case' 0 C--O 1.236 0.383 0 C-N-CA 129.327 3.051 . . . . 0.0 112.022 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.95 38.04 30.38 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.881 1.229 . . . . 0.0 111.545 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -139.82 179.04 6.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.347 1.859 . . . . 0.0 112.307 -176.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -74.67 -169.19 0.82 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.532 2.733 . . . . 0.0 107.91 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.254 22.8 p -80.16 120.46 24.32 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 119.385 -2.072 . . . . 0.0 109.363 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -168.83 143.41 3.18 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 129.604 3.161 . . . . 0.0 106.548 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 41.3 p90 -164.44 173.17 12.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 119.285 0.948 . . . . 0.0 109.139 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -130.67 123.27 54.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 O-C-N 121.538 -0.726 . . . . 0.0 109.512 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -137.26 145.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 104.632 -2.358 . . . . 0.0 104.632 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.1 t0 53.47 35.33 20.38 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 122.419 1.104 . . . . 0.0 111.399 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 57.59 22.83 8.61 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.347 1.859 . . . . 0.0 113.126 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -123.41 150.77 43.36 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.618 1.567 . . . . 0.0 109.305 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.8 m -79.29 123.05 27.08 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.402 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 8.4 m-85 -127.5 161.35 28.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.423 1.489 . . . . 0.0 109.087 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.433 ' CE2' HG22 ' A' ' 29' ' ' THR . 31.3 p90 -149.17 167.38 26.12 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.004 -1.06 . . . . 0.0 108.408 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -97.45 127.58 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.433 HG22 ' CE2' ' A' ' 27' ' ' PHE . 30.3 p -94.99 167.49 11.36 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.752 1.221 . . . . 0.0 111.689 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -75.15 -13.0 60.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.978 1.711 . . . . 0.0 111.988 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -69.59 102.77 1.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.645 1.578 . . . . 0.0 109.6 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -89.93 145.64 24.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.47 139.93 22.55 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.599 1.959 . . . . 0.0 108.823 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.59 148.61 20.59 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.26 2.64 . . . . 0.0 109.893 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -55.27 -31.97 61.99 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.26 -19.39 64.51 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.58 0.752 . . . . 0.0 112.629 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -101.84 -9.76 20.48 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.523 0.729 . . . . 0.0 111.064 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.6 t -74.87 124.2 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -73.66 -59.57 2.65 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.375 1.07 . . . . 0.0 110.799 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.19 169.07 6.58 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 126.172 1.789 . . . . 0.0 109.63 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 57.5 p -62.48 169.61 2.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.301 1.84 . . . . 0.0 112.913 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -140.51 -47.71 0.43 Allowed 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 116.746 -1.597 . . . . 0.0 114.364 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 t -153.06 130.02 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 121.248 1.84 . . . . 0.0 111.416 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -99.29 106.13 18.22 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.296 1.038 . . . . 0.0 111.042 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -128.87 158.04 39.87 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 129.65 3.18 . . . . 0.0 106.166 178.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.03 109.83 6.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.487 1.04 . . . . 0.0 109.761 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.494 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.36 139.0 22.85 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.985 0.811 . . . . 0.0 109.898 178.037 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.494 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.2 tt -133.53 141.76 47.89 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.465 1.506 . . . . 0.0 108.53 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -148.92 171.16 16.78 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.183 1.393 . . . . 0.0 110.74 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.4 mt -127.3 142.57 43.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.76 1.224 . . . . 0.0 110.725 -178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.484 ' C ' ' HG ' ' A' ' 66' ' ' SER . 4.5 t -137.48 128.83 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.711 1.204 . . . . 0.0 111.712 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -73.62 111.48 8.8 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.801 1.64 . . . . 0.0 108.041 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 63.0 mtp -56.99 -25.22 57.96 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.355 1.434 . . . . 0.0 113.494 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? -60.09 -53.52 56.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.947 0.499 . . . . 0.0 111.05 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.5 m -106.12 -6.54 18.53 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 59.57 30.84 20.51 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.803 2.041 . . . . 0.0 109.878 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.94 154.01 24.71 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 124.923 1.289 . . . . 0.0 112.34 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.11 150.1 49.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.22 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.3 mt -127.45 174.31 9.11 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 124.417 1.087 . . . . 0.0 110.781 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -108.96 0.45 20.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.802 2.041 . . . . 0.0 113.028 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.1 p -163.01 162.98 26.22 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.543 1.137 . . . . 0.0 108.413 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.7 m -91.72 117.43 29.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.486 1.914 . . . . 0.0 112.818 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -124.35 157.22 35.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.97 1.708 . . . . 0.0 109.317 177.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -56.28 -18.03 9.39 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -96.66 4.18 52.04 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.364 0.666 . . . . 0.0 111.072 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.484 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 22.5 t -120.32 169.53 10.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.995 2.118 . . . . 0.0 107.92 -179.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 92.5 t -143.47 145.38 22.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 t -95.46 142.18 28.13 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 106.479 -1.675 . . . . 0.0 106.479 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.2 mt -123.6 151.73 42.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.7 t -128.49 104.33 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 105.332 -2.099 . . . . 0.0 105.332 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -97.94 95.12 7.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.601 1.092 . . . . 0.0 109.837 -178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.49 -167.75 0.93 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 56.0 67.9 0.94 Allowed 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.418 1.087 . . . . 0.0 113.701 175.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.3 mt -77.87 139.99 17.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 121.195 -0.941 . . . . 0.0 109.038 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.82 168.41 19.88 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.834 2.054 . . . . 0.0 109.229 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -115.23 151.22 34.87 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 126.363 1.865 . . . . 0.0 107.204 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.12 159.99 16.43 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.527 1.531 . . . . 0.0 109.837 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -59.54 -33.24 71.15 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.986 0.914 . . . . 0.0 110.779 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -83.05 17.0 2.1 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.877 1.271 . . . . 0.0 110.405 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp 68.65 2.09 3.29 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.84 2.056 . . . . 0.0 111.142 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 44.3 m -70.01 160.98 30.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.95 146.09 41.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.542 1.137 . . . . 0.0 108.145 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.2 p -142.48 167.14 22.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.542 -0.724 . . . . 0.0 110.609 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 36.0 ttm -134.13 137.47 44.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.552 1.941 . . . . 0.0 109.029 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.6 123.38 6.03 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 127.336 2.398 . . . . 0.0 111.087 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.7 mt -138.98 117.32 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 50.67 43.69 27.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.901 0.881 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 73.94 -1.28 3.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.123 2.569 . . . . 0.0 115.357 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -105.45 134.76 48.04 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.968 1.307 . . . . 0.0 108.6 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -89.89 117.09 28.45 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.12 0.568 . . . . 0.0 109.819 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -109.02 130.24 55.47 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.289 1.436 . . . . 0.0 110.742 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -62.89 147.76 49.29 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.308 0.643 . . . . 0.0 110.387 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -115.95 133.46 62.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.21 161.05 56.56 Favored Pre-proline 0 C--O 1.236 0.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.952 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -74.95 144.29 30.26 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 122.696 2.264 . . . . 0.0 109.05 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -58.11 -18.18 23.31 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.78 -11.1 59.99 Favored 'General case' 0 N--CA 1.445 -0.71 0 O-C-N 121.006 -1.059 . . . . 0.0 112.571 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.5 1.66 28.5 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.34 1.427 . . . . 0.0 112.426 178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -46.11 144.42 1.94 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 126.606 1.962 . . . . 0.0 112.279 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.43 -43.11 1.94 Allowed Glycine 0 CA--C 1.518 0.251 0 C-N-CA 127.172 2.32 . . . . 0.0 110.662 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.06 -18.17 22.1 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 117.936 0.868 . . . . 0.0 110.457 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.0 t -138.62 158.1 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 125.832 1.653 . . . . 0.0 107.713 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -141.98 168.63 19.28 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 127.938 2.495 . . . . 0.0 106.629 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.63 -179.66 1.46 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.744 0.783 . . . . 0.0 111.038 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.95 173.25 10.23 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -123.39 141.86 51.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.719 1.208 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.97 -8.84 52.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.403 0.681 . . . . 0.0 111.787 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.24 -22.37 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.964 1.706 . . . . 0.0 110.942 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.97 -5.57 49.16 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.833 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 124.843 1.257 . . . . 0.0 111.556 -177.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -129.78 125.45 35.82 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.204 1.002 . . . . 0.0 109.223 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.4 t -104.39 165.11 11.27 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.499 1.52 . . . . 0.0 108.359 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.04 -33.17 0.45 Allowed 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 49.76 63.47 2.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 120.513 1.506 . . . . 0.0 110.692 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -122.42 174.97 6.7 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.375 1.47 . . . . 0.0 109.276 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.421 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 14.6 ttmm -99.75 168.61 9.8 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.421 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 24.1 t -126.71 126.12 68.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -91.67 135.72 33.67 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -106.18 165.35 11.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.49 -33.54 48.11 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 53.19 98.08 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.996 1.718 . . . . 0.0 113.386 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 9.25 37.46 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 125.466 1.508 . . . . 0.0 112.955 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.9 m -131.6 178.68 6.55 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 127.39 2.276 . . . . 0.0 109.469 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.4 -167.9 0.48 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 130.733 3.613 . . . . 0.0 107.833 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.4 p -78.87 121.13 24.44 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 124.317 2.008 . . . . 0.0 109.642 -176.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -167.0 143.84 4.58 Favored 'General case' 0 N--CA 1.448 -0.558 1 C-N-CA 132.299 4.24 . . . . 0.0 104.6 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.4 p90 -165.2 171.26 13.9 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 125.044 1.338 . . . . 0.0 107.447 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -132.72 123.53 49.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 O-C-N 121.558 -0.714 . . . . 0.0 109.533 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -128.07 136.64 51.49 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 125.515 1.526 . . . . 0.0 107.019 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.4 t70 52.45 34.95 16.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.272 1.429 . . . . 0.0 110.355 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 64.64 12.73 7.78 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.795 2.038 . . . . 0.0 112.593 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -106.38 138.08 43.2 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 126.216 1.807 . . . . 0.0 108.299 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -68.72 136.64 53.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -144.9 159.27 43.17 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.976 0.911 . . . . 0.0 109.275 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -149.36 164.26 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.394 -0.816 . . . . 0.0 109.174 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 t -97.63 132.31 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.27 175.57 5.43 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.379 0.609 . . . . 0.0 109.729 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -77.06 -11.09 59.76 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.38 1.072 . . . . 0.0 113.208 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.19 110.97 5.48 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.211 1.004 . . . . 0.0 108.871 178.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -98.88 143.42 29.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.2 mp -118.75 136.19 24.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.67 159.44 52.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.931 2.421 . . . . 0.0 112.905 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -61.83 -27.75 68.99 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -71.77 -22.67 61.56 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.946 0.794 . . . . 0.0 110.093 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -84.47 -24.7 29.35 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -64.81 147.07 12.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -112.08 -60.97 1.78 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.602 1.161 . . . . 0.0 110.937 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -153.93 168.01 27.82 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.391 0.676 . . . . 0.0 112.486 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 p -69.87 147.57 50.13 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 126.12 1.768 . . . . 0.0 109.196 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -119.25 -52.6 2.28 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 117.791 -1.1 . . . . 0.0 111.404 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 t -149.11 118.59 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 119.787 1.176 . . . . 0.0 112.598 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -86.03 101.45 12.94 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 177.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.49 158.23 34.99 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 128.834 2.854 . . . . 0.0 107.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -141.12 108.16 5.45 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 120.21 1.368 . . . . 0.0 111.984 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.531 ' HE2' ' CD2' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -148.13 138.58 22.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.325 -0.859 . . . . 0.0 110.432 178.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -130.76 145.08 51.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 127.467 2.307 . . . . 0.0 108.15 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.531 ' CD2' ' HE2' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -150.24 171.34 17.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.394 1.877 . . . . 0.0 109.03 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.0 mt -128.22 131.93 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 124.433 1.093 . . . . 0.0 108.104 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.59 130.21 74.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.296 1.038 . . . . 0.0 111.01 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.63 122.61 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 127.244 2.217 . . . . 0.0 110.109 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.0 mmm -69.25 -21.8 63.88 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -83.07 -53.26 5.94 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.495 1.118 . . . . 0.0 110.991 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.3 m -92.4 -11.01 36.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.105 -178.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 60.89 23.43 13.48 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 120.073 1.306 . . . . 0.0 110.766 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 mtpp -110.98 162.7 14.58 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.944 1.298 . . . . 0.0 111.371 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.98 146.57 41.57 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.29 0.636 . . . . 0.0 110.88 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.405 HD13 ' HG ' ' A' ' 66' ' ' SER . 70.5 mt -135.22 174.98 10.01 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.87 1.668 . . . . 0.0 109.761 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.9 m -115.09 -8.65 12.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.607 1.163 . . . . 0.0 110.455 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.6 m -116.92 127.11 53.92 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.569 1.148 . . . . 0.0 113.086 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.1 t -80.13 99.23 7.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -121.41 166.84 13.52 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.369 0.668 . . . . 0.0 109.984 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -56.5 -36.78 69.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -87.73 18.53 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.065 0.546 . . . . 0.0 110.401 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.405 ' HG ' HD13 ' A' ' 59' ' ' LEU . 35.8 t -138.37 154.46 48.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 126.173 1.789 . . . . 0.0 108.678 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.64 139.87 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.052 0.941 . . . . 0.0 109.194 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.71 144.37 26.04 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.938 0.895 . . . . 0.0 109.543 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -136.15 150.47 49.07 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.013 1.325 . . . . 0.0 107.519 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 t -125.37 103.35 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.29 95.26 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.59 -174.82 4.65 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.81 68.95 0.48 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.73 2.012 . . . . 0.0 114.616 178.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.6 mt -68.9 145.36 13.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.679 1.192 . . . . 0.0 110.107 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -140.12 169.69 17.22 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 128.134 2.574 . . . . 0.0 110.414 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -115.78 163.68 15.48 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 127.781 2.432 . . . . 0.0 108.672 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -120.86 168.64 11.25 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.799 2.04 . . . . 0.0 109.994 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -57.3 -36.93 71.69 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.97 18.78 2.84 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.874 1.27 . . . . 0.0 111.403 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt 66.14 9.86 6.61 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.065 1.346 . . . . 0.0 112.261 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 t -73.92 137.92 43.95 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -100.18 150.46 22.49 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 122.974 0.51 . . . . 0.0 109.808 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.1 p -145.68 171.11 15.2 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.802 0.441 . . . . 0.0 112.117 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.9 ttm -137.18 142.17 42.17 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.1 1.76 . . . . 0.0 110.644 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.81 129.55 9.14 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 124.772 1.177 . . . . 0.0 110.824 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.9 mt -147.6 126.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 50.69 39.99 23.03 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.765 0.826 . . . . 0.0 110.396 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 63.54 15.55 8.93 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.975 2.11 . . . . 0.0 114.755 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -118.22 140.34 49.95 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 125.495 1.518 . . . . 0.0 107.388 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -91.33 116.15 28.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.903 -0.498 . . . . 0.0 110.81 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.28 127.25 53.38 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.975 1.31 . . . . 0.0 109.769 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.98 154.65 21.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.184 0.993 . . . . 0.0 110.216 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -120.24 132.66 69.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -120.42 155.47 56.36 Favored Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 124.486 1.114 . . . . 0.0 110.286 -178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.35 147.87 60.04 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.706 2.271 . . . . 0.0 107.864 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.11 -18.43 47.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.136 0.426 . . . . 0.0 111.919 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.6 t -67.51 -21.61 65.48 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 121.301 -0.875 . . . . 0.0 109.964 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -79.66 -3.11 45.79 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.119 0.968 . . . . 0.0 113.392 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -52.62 155.87 2.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.313 1.054 . . . . 0.0 109.571 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.85 -42.51 2.65 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.24 -32.47 24.44 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 p -137.7 162.37 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 C-N-CA 125.957 1.703 . . . . 0.0 108.955 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -136.31 170.61 15.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.922 2.489 . . . . 0.0 107.529 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.11 166.24 2.95 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.797 0.808 . . . . 0.0 110.699 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.15 171.9 3.39 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.177 0.591 . . . . 0.0 111.558 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -127.29 136.29 51.76 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.722 0.809 . . . . 0.0 111.162 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.32 -21.32 65.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 124.342 1.057 . . . . 0.0 112.2 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -60.05 -10.85 4.72 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -81.9 -0.43 43.73 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.867 0.758 . . . . 0.0 109.81 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.245 0.839 0 C-N-CA 127.579 2.352 . . . . 0.0 107.914 -179.454 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -99.54 -176.99 3.44 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.19 1.396 . . . . 0.0 108.326 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -132.85 69.76 1.48 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 p -67.92 65.78 0.09 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.564 2.346 . . . . 0.0 111.931 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -136.62 2.59 2.69 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.518 1.927 . . . . 0.0 112.458 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.4 145.26 24.78 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 120.908 -1.12 . . . . 0.0 109.39 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.74 167.25 7.66 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 127.882 2.473 . . . . 0.0 111.583 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.8 t -132.96 130.62 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.7 ttm-85 -102.6 115.83 31.36 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -86.81 166.77 14.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -75.19 -33.04 61.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.933 0.788 . . . . 0.0 112.104 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 60.41 117.73 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.297 1.839 . . . . 0.0 114.295 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.63 18.96 78.54 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -137.94 178.04 7.42 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.938 1.695 . . . . 0.0 111.184 -178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -74.18 -168.38 0.63 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 128.707 2.803 . . . . 0.0 108.937 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.4 p -79.12 120.16 23.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.436 2.065 . . . . 0.0 107.849 -176.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -168.64 145.76 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 130.353 3.461 . . . . 0.0 105.941 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -165.21 174.91 9.75 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.215 2.206 . . . . 0.0 106.771 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 73.2 mt -135.44 128.28 47.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -137.09 140.63 42.09 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.2 t70 51.83 39.19 25.16 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.9 1.68 . . . . 0.0 112.489 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.61 16.78 10.66 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.629 1.572 . . . . 0.0 112.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -120.2 141.87 49.52 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.872 1.269 . . . . 0.0 110.08 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.9 m -72.33 127.42 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.691 1.597 . . . . 0.0 108.706 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -140.39 160.03 40.89 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.565 0.746 . . . . 0.0 112.34 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -148.8 162.57 39.53 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 121.21 -0.931 . . . . 0.0 111.189 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.2 t -92.23 127.55 44.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 124.097 0.959 . . . . 0.0 109.894 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.8 p -98.97 171.13 8.24 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.817 1.247 . . . . 0.0 109.863 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -81.17 -10.9 59.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.998 1.719 . . . . 0.0 112.598 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.29 111.5 5.94 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.552 1.941 . . . . 0.0 109.692 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.8 tt0 -95.96 146.36 24.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.309 1.444 . . . . 0.0 111.864 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.99 131.77 24.01 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.748 2.419 . . . . 0.0 107.253 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.95 156.28 47.82 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.591 2.86 . . . . 0.0 112.484 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -58.26 -26.6 63.12 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.085 0.954 . . . . 0.0 113.5 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.41 -26.21 63.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.317 0.508 . . . . 0.0 110.665 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -82.82 -25.33 32.79 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.56 118.2 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.014 0.925 . . . . 0.0 108.598 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.77 -61.04 2.12 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.049 0.94 . . . . 0.0 109.776 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -159.75 173.63 15.73 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.86 0.864 . . . . 0.0 109.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.421 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 70.0 m -62.91 171.36 2.2 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.024 1.33 . . . . 0.0 110.933 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -145.79 -45.03 0.21 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 120.559 -1.338 . . . . 0.0 113.746 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.2 t -152.44 132.88 4.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-N 118.983 0.811 . . . . 0.0 109.693 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -109.52 109.01 19.69 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.094 1.358 . . . . 0.0 107.782 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -139.39 157.41 45.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 127.894 2.478 . . . . 0.0 107.274 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -125.27 107.48 10.76 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -145.59 122.72 11.46 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.835 0.743 . . . . 0.0 109.332 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.4 tt -129.73 143.36 50.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 128.548 2.739 . . . . 0.0 106.575 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.23 170.54 19.77 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 126.047 1.739 . . . . 0.0 107.245 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.5 mt -129.22 132.02 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.1 t -121.98 136.16 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.047 1.339 . . . . 0.0 108.755 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -78.85 119.04 21.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 126.001 1.72 . . . . 0.0 109.301 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.9 mtp -68.44 -19.53 64.58 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 121.789 2.086 . . . . 0.0 111.531 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -38.27 69.08 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 117.914 -1.041 . . . . 0.0 113.638 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.3 p -121.98 -9.06 8.79 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 60.31 41.19 16.74 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 125.969 1.707 . . . . 0.0 111.024 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -122.47 158.26 30.15 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.902 1.281 . . . . 0.0 109.491 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.02 146.95 49.07 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.02 0.528 . . . . 0.0 111.734 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.6 mt -132.64 158.17 42.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.704 1.602 . . . . 0.0 110.3 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -86.75 -21.84 26.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.524 0.73 . . . . 0.0 110.726 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -135.95 146.79 47.65 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.462 1.505 . . . . 0.0 111.246 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.64 98.85 11.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 127.595 2.358 . . . . 0.0 112.03 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -97.08 171.76 8.27 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.8 -0.563 . . . . 0.0 110.155 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -53.61 -21.89 7.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.697 2.399 . . . . 0.0 117.462 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -105.73 1.17 26.86 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.578 1.951 . . . . 0.0 110.675 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.7 t -114.69 161.83 17.62 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.974 1.71 . . . . 0.0 110.63 -177.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.2 t -138.55 126.46 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 124.612 1.165 . . . . 0.0 109.284 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.9 t -77.31 143.09 39.07 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.9 mt -130.21 145.41 51.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.38 103.69 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.26 93.03 6.66 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.31 -162.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 44.17 67.28 0.7 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.699 1.999 . . . . 0.0 111.482 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 mt -75.14 142.64 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.427 1.091 . . . . 0.0 110.105 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.421 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 73.6 m-85 -141.87 158.6 43.59 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -103.03 165.5 10.99 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.718 1.207 . . . . 0.0 110.104 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.24 169.99 12.31 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.733 0.813 . . . . 0.0 112.736 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -58.78 -41.1 85.88 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.245 1.418 . . . . 0.0 109.814 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.03 13.24 5.22 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.579 1.951 . . . . 0.0 109.797 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.46 10.98 5.23 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.85 2.06 . . . . 0.0 110.922 -177.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.2 m -65.41 149.58 49.76 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -111.32 140.23 46.06 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.13 175.2 9.82 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.818 0.847 . . . . 0.0 112.086 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.8 ttm -134.83 142.14 46.57 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.9 2.08 . . . . 0.0 108.967 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.65 125.78 8.09 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.953 -1.659 . . . . 0.0 108.953 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.2 mt -142.6 121.53 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 48.35 54.94 9.59 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.254 1.421 . . . . 0.0 113.51 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 69.25 -2.84 1.71 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.88 1.672 . . . . 0.0 114.712 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -112.78 156.7 22.41 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 125.129 1.372 . . . . 0.0 109.469 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.69 117.0 29.6 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.14 0.976 . . . . 0.0 109.396 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.76 133.64 52.91 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.269 1.428 . . . . 0.0 112.175 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ttpt -63.1 145.07 56.25 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.757 0.823 . . . . 0.0 110.877 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -110.36 132.63 58.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -126.46 156.32 73.07 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.19 161.8 42.18 Favored 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 122.247 1.965 . . . . 0.0 111.057 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -21.25 66.46 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.56 -6.04 37.77 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.024 1.33 . . . . 0.0 112.579 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.33 -3.94 36.05 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.374 0.988 . . . . 0.0 111.69 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 20.1 mmtm -54.47 156.96 3.06 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-N 119.596 1.089 . . . . 0.0 111.873 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 108.49 -42.81 1.85 Allowed Glycine 0 CA--C 1.521 0.464 0 N-CA-C 108.396 -1.882 . . . . 0.0 108.396 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.37 -42.25 8.99 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.1 159.96 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 125.617 1.567 . . . . 0.0 110.77 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -143.07 173.29 11.7 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.694 2.798 . . . . 0.0 107.0 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.6 164.88 4.18 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.655 1.182 . . . . 0.0 110.359 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 172.96 3.89 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -116.97 127.39 54.15 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 125.385 1.474 . . . . 0.0 108.655 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.434 HD13 ' H ' ' A' ' 107' ' ' LEU . 0.5 OUTLIER -64.93 -20.17 66.32 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.578 0.751 . . . . 0.0 111.121 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -55.04 -24.86 26.91 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.54 1.536 . . . . 0.0 111.782 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -68.86 -16.0 63.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.495 -0.753 . . . . 0.0 110.416 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 125.999 1.72 . . . . 0.0 109.789 -178.98 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -133.15 178.87 6.57 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 119.759 -1.838 . . . . 0.0 107.813 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.6 t -154.76 163.01 40.87 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.342 -0.849 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.9 t -111.25 90.48 3.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 126.217 1.807 . . . . 0.0 106.255 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -57.41 122.41 12.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.541 1.136 . . . . 0.0 108.927 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -139.31 168.18 20.42 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.003 1.321 . . . . 0.0 110.373 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -65.12 133.71 52.17 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 178.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.43 135.89 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.1 ttt-85 -107.91 98.52 8.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -82.24 148.92 28.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.55 -33.73 73.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 117.885 -1.055 . . . . 0.0 112.686 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 79.06 131.07 0.05 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 129.7 3.2 . . . . 0.0 114.281 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.41 34.49 54.64 Favored Glycine 0 CA--C 1.522 0.501 0 C-N-CA 126.088 1.804 . . . . 0.0 111.196 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.9 p -137.83 178.48 7.08 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 110.575 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.78 -170.08 0.65 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.891 2.076 . . . . 0.0 109.328 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.3 p -79.6 120.22 23.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 123.927 1.822 . . . . 0.0 108.535 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -167.44 149.95 5.98 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 130.976 3.71 . . . . 0.0 105.014 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 42.7 p90 -172.88 175.86 3.22 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.4 mt -134.56 130.94 53.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -130.61 138.15 49.97 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.6 t0 47.57 42.97 15.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.747 1.619 . . . . 0.0 113.832 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 61.0 22.51 12.75 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 0.0 112.877 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -122.9 128.64 50.6 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.222 1.809 . . . . 0.0 106.623 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 71.2 m -74.75 132.25 41.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -130.35 166.28 20.75 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 127.013 2.125 . . . . 0.0 110.348 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -148.54 166.35 28.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -99.63 126.93 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.2 p -93.26 171.18 9.08 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.896 0.878 . . . . 0.0 110.291 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -77.86 -15.67 58.87 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.463 1.505 . . . . 0.0 111.53 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.8 122.77 18.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.991 1.317 . . . . 0.0 110.618 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.454 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 32.6 tt0 -111.0 145.68 38.02 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.227 1.411 . . . . 0.0 110.394 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.64 141.23 27.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.651 1.18 . . . . 0.0 108.654 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.99 152.15 51.19 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.208 2.605 . . . . 0.0 110.352 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.55 -33.04 63.5 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.475 ' HG3' HD21 ' A' ' 37' ' ' ASN . 9.4 pt-20 -64.56 -20.8 66.46 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.475 HD21 ' HG3' ' A' ' 36' ' ' GLU . 2.3 m-80 -90.97 -15.38 29.81 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.566 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.2 t -70.9 123.75 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.906 0.882 . . . . 0.0 108.623 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -62.04 1.72 Allowed 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.87 173.01 14.27 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.135 0.88 . . . . 0.0 110.825 178.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.5 p -65.34 135.78 55.72 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 125.49 1.516 . . . . 0.0 110.206 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.98 -49.39 3.14 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 116.996 -1.478 . . . . 0.0 112.656 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.8 t -143.92 122.01 6.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 120.185 1.357 . . . . 0.0 112.052 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -83.05 114.31 21.2 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.11 158.84 44.58 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 127.828 2.451 . . . . 0.0 109.623 -178.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -143.44 119.75 10.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.011 0.924 . . . . 0.0 109.434 178.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -148.08 136.61 21.57 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -133.59 144.71 49.46 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.338 1.855 . . . . 0.0 109.072 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.3 169.67 24.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.016 1.327 . . . . 0.0 109.551 177.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.9 mt -126.43 136.0 62.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 125.492 1.517 . . . . 0.0 107.898 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.2 t -134.82 134.25 53.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 125.911 1.684 . . . . 0.0 109.991 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -72.13 116.81 12.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 127.917 2.487 . . . . 0.0 111.699 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.7 mtp -68.24 -18.28 64.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.128 0.876 . . . . 0.0 112.176 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -66.43 -53.78 31.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.818 1.19 . . . . 0.0 111.372 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.7 m -122.6 8.61 9.53 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 59.44 47.09 11.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.227 1.811 . . . . 0.0 112.939 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -116.64 147.17 42.17 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.368 1.067 . . . . 0.0 108.883 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mp -69.52 155.8 39.9 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.628 ' CD1' HD22 ' A' ' 63' ' ' ASN . 86.8 mt -135.36 157.81 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.723 1.209 . . . . 0.0 110.465 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.9 p -88.1 -12.44 44.13 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.285 -1.34 . . . . 0.0 114.194 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 p -147.66 148.99 31.64 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 121.136 1.789 . . . . 0.0 112.31 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -69.77 116.97 10.77 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.862 1.265 . . . . 0.0 109.393 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.628 HD22 ' CD1' ' A' ' 59' ' ' LEU . 4.4 p30 -137.43 156.64 47.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.18 1.392 . . . . 0.0 109.806 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -54.44 -31.64 55.84 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -80.39 3.57 20.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.322 0.965 . . . . 0.0 111.311 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -124.47 177.01 6.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.934 1.694 . . . . 0.0 111.616 -177.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.0 t -142.46 150.28 18.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 127.959 2.503 . . . . 0.0 105.831 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.8 t -102.61 140.63 36.63 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.32 144.84 50.3 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 t -115.9 103.32 15.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.87 94.37 8.9 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.361 -1.462 . . . . 0.0 107.39 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.25 -173.76 3.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -177.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 46.45 69.46 0.48 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.335 1.854 . . . . 0.0 114.815 177.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.3 mt -70.01 143.87 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.53 169.39 17.87 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.775 2.03 . . . . 0.0 108.833 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -117.96 154.13 32.46 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.28 161.07 16.4 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.526 1.13 . . . . 0.0 110.009 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -65.78 -13.36 59.27 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.274 0.63 . . . . 0.0 111.421 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 2.89 56.41 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.224 1.41 . . . . 0.0 109.472 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm 79.6 -1.59 2.16 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 129.157 2.983 . . . . 0.0 112.11 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.5 m -77.35 162.38 27.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 120.55 1.523 . . . . 0.0 108.099 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.17 158.43 17.44 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.224 1.01 . . . . 0.0 109.639 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.3 p -149.32 172.79 14.32 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.037 0.835 . . . . 0.0 109.522 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.3 ttm -136.03 135.85 39.77 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.789 1.636 . . . . 0.0 108.449 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.26 109.88 3.12 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 74.9 mt -123.03 123.81 68.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.9 m120 51.7 37.91 21.41 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.794 1.237 . . . . 0.0 109.609 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 69.24 16.31 8.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.89 2.876 . . . . 0.0 114.554 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -117.17 132.75 56.58 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -86.5 115.92 24.3 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.569 -0.707 . . . . 0.0 110.252 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.454 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 76.4 m-85 -110.21 128.27 55.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.861 1.265 . . . . 0.0 111.295 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.94 144.63 52.76 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.037 0.935 . . . . 0.0 110.315 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.57 132.91 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.36 156.48 57.78 Favored Pre-proline 0 N--CA 1.467 0.384 0 C-N-CA 124.457 1.103 . . . . 0.0 108.658 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -75.12 156.41 42.47 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.23 1.953 . . . . 0.0 108.505 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -65.5 -11.18 41.03 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.464 -0.773 . . . . 0.0 110.958 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -21.93 63.81 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.166 -0.959 . . . . 0.0 109.503 177.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.9 -7.39 59.6 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.483 1.113 . . . . 0.0 111.823 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -56.07 149.33 15.84 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 107.87 -32.05 7.43 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -178.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.97 -8.97 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.416 1.486 . . . . 0.0 111.887 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -150.54 150.2 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 C-N-CA 126.404 1.882 . . . . 0.0 107.13 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -131.06 169.67 15.55 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.765 1.626 . . . . 0.0 107.994 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.65 163.4 11.44 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.126 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.35 167.65 10.16 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt85 -110.36 135.67 50.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 126.148 1.779 . . . . 0.0 110.753 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -68.77 -15.58 63.55 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -59.03 -23.02 61.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.186 1.794 . . . . 0.0 111.441 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.5 m-20 -73.57 -6.02 43.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 118.341 -0.837 . . . . 0.0 111.981 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.565 1.546 . . . . 0.0 111.755 -177.822 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -109.05 131.15 55.35 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 -53.77 9.55 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.77 1.628 . . . . 0.0 113.157 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.9 t -52.33 124.54 13.56 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.684 1.993 . . . . 0.0 113.751 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -135.66 129.88 33.44 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 126.788 2.035 . . . . 0.0 108.16 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -147.4 156.39 42.83 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.097 2.159 . . . . 0.0 108.396 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -60.66 163.52 5.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.539 1.063 . . . . 0.0 110.161 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.3 t -110.12 130.55 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -89.15 116.97 27.8 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -85.08 153.3 22.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -59.66 -34.34 72.71 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 128.109 2.564 . . . . 0.0 113.96 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 59.66 103.64 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 127.944 2.498 . . . . 0.0 113.704 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.93 31.84 69.84 Favored Glycine 0 CA--C 1.528 0.88 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.279 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -134.71 179.88 6.02 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.397 1.879 . . . . 0.0 112.659 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.53 -168.59 0.45 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.155 2.582 . . . . 0.0 107.502 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -78.46 120.37 23.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 116.993 -1.883 . . . . 0.0 108.295 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -168.06 146.68 4.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 128.949 2.899 . . . . 0.0 107.808 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -170.87 177.05 3.92 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.321 0.964 . . . . 0.0 109.429 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 44.1 mt -135.65 126.28 43.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 121.446 -0.784 . . . . 0.0 109.031 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -129.86 134.24 47.4 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 105.576 -2.009 . . . . 0.0 105.576 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.8 t0 53.15 38.09 26.64 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.255 1.022 . . . . 0.0 112.49 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 m120 62.57 16.02 8.43 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.482 2.313 . . . . 0.0 113.112 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -111.4 136.95 49.82 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.46 1.104 . . . . 0.0 108.796 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -71.55 122.24 20.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.449 1.5 . . . . 0.0 107.611 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -134.48 162.33 32.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.181 1.393 . . . . 0.0 109.957 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.416 ' CE2' HG22 ' A' ' 29' ' ' THR . 25.2 p90 -149.27 171.89 15.76 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.397 1.079 . . . . 0.0 108.527 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 t -100.82 125.26 54.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.416 HG22 ' CE2' ' A' ' 27' ' ' PHE . 8.5 p -96.52 170.47 9.19 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.521 1.129 . . . . 0.0 111.081 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -77.72 -9.44 59.0 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.185 1.794 . . . . 0.0 112.961 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -70.19 97.46 1.21 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.858 1.263 . . . . 0.0 108.523 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -89.14 145.1 25.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 123.655 0.782 . . . . 0.0 109.672 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.95 142.77 33.91 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 126.514 1.926 . . . . 0.0 112.399 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.79 146.82 30.35 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 123.836 3.024 . . . . 0.0 109.728 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -53.99 -31.52 51.2 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.741 1.216 . . . . 0.0 113.874 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.72 -29.06 69.53 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.317 -0.864 . . . . 0.0 111.1 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -84.58 -15.46 45.57 Favored 'General case' 0 C--O 1.23 0.053 0 O-C-N 121.157 -0.964 . . . . 0.0 109.109 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.4 t -77.18 114.04 17.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.414 HD21 ' C ' ' A' ' 39' ' ' ASN . 0.1 OUTLIER -68.09 -61.26 1.94 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 124.915 1.286 . . . . 0.0 109.5 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.2 169.47 20.71 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.402 1.001 . . . . 0.0 110.502 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 p -71.58 151.72 43.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt -118.58 -38.78 3.08 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.492 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 t -147.57 140.87 19.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 118.548 0.613 . . . . 0.0 111.905 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -113.88 93.95 4.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 125.596 1.558 . . . . 0.0 107.875 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -140.24 156.46 46.48 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 128.35 2.66 . . . . 0.0 105.549 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -131.01 126.49 36.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.291 1.836 . . . . 0.0 108.709 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE3' HD22 ' A' ' 71' ' ' LEU . 0.6 OUTLIER -147.37 129.99 15.96 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 tt -134.55 144.51 48.03 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.977 1.711 . . . . 0.0 108.175 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.45 169.88 23.6 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 125.918 1.687 . . . . 0.0 107.8 178.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -128.01 134.71 64.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 119.56 1.073 . . . . 0.0 108.343 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.406 ' C ' ' HG ' ' A' ' 66' ' ' SER . 21.6 t -124.63 133.68 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 125.061 1.344 . . . . 0.0 110.617 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -71.69 119.3 15.65 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.858 2.063 . . . . 0.0 108.506 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.1 mtp -68.72 -17.34 64.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.871 0.76 . . . . 0.0 112.684 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 7.4 mmpt? -79.81 -53.93 6.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.302 1.41 . . . . 0.0 112.47 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.6 m -97.31 -7.72 31.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 66.31 14.91 9.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.018 1.727 . . . . 0.0 110.846 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -99.11 155.25 17.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 125.631 1.572 . . . . 0.0 111.454 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.5 mp -74.0 157.46 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 177.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.7 mt -126.68 -174.4 3.12 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.794 1.238 . . . . 0.0 112.091 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -13.77 15.92 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.465 1.906 . . . . 0.0 113.525 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 p -149.37 -172.41 4.13 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.615 1.166 . . . . 0.0 108.505 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.5 t -113.86 106.82 14.9 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -109.41 164.41 12.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 125.187 1.395 . . . . 0.0 109.061 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -10.96 6.04 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.682 1.593 . . . . 0.0 114.732 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.03 14.71 20.81 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.583 1.083 . . . . 0.0 109.001 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.406 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 17.4 t -131.87 167.18 20.04 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.51 1.524 . . . . 0.0 109.898 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -140.87 135.23 33.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 125.215 1.406 . . . . 0.0 109.0 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 t -79.43 142.9 35.5 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.8 mt -132.85 133.16 42.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -113.16 103.44 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 103.228 -2.879 . . . . 0.0 103.228 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.433 HD22 ' HE3' ' A' ' 47' ' ' LYS . 1.9 mm? -97.93 91.89 5.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 -178.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.87 -163.76 0.74 Allowed 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -176.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 54.13 67.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.963 0.887 . . . . 0.0 112.109 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.7 mt -80.79 133.71 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.346 -0.846 . . . . 0.0 110.239 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -133.39 169.71 16.54 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.566 1.946 . . . . 0.0 110.093 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -117.66 150.31 39.26 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.881 2.072 . . . . 0.0 109.745 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.99 168.49 9.02 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 126.86 2.064 . . . . 0.0 110.214 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.5 m -53.85 -37.95 64.17 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.242 1.017 . . . . 0.0 113.449 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -85.76 11.91 10.1 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 126.136 1.775 . . . . 0.0 113.211 -177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.7 mptt 74.73 1.21 3.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.921 1.689 . . . . 0.0 110.223 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.8 t -71.21 152.33 43.45 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 104.821 -2.288 . . . . 0.0 104.821 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.28 153.17 24.25 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.628 0.771 . . . . 0.0 109.744 -178.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.6 p -139.62 168.33 20.06 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.517 1.127 . . . . 0.0 109.647 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.9 ttm -133.83 138.35 45.6 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.075 1.75 . . . . 0.0 109.703 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.27 118.84 4.71 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 127.279 2.371 . . . . 0.0 111.184 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.7 mt -137.0 119.66 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 51.48 44.21 29.15 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.625 0.77 . . . . 0.0 109.264 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 56.6 m-20 62.41 17.83 9.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.054 2.142 . . . . 0.0 114.676 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -118.48 131.27 56.25 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 124.371 1.068 . . . . 0.0 109.113 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -86.74 116.29 24.74 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 122.338 0.255 . . . . 0.0 111.031 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -109.08 123.63 49.48 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.272 2.229 . . . . 0.0 109.547 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -59.92 142.38 53.77 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.725 1.61 . . . . 0.0 111.289 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -110.45 133.66 55.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -129.36 163.42 46.45 Favored Pre-proline 0 N--CA 1.468 0.459 0 C-N-CA 125.886 1.675 . . . . 0.0 110.999 -177.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.59 152.22 37.82 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.68 2.253 . . . . 0.0 111.084 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.4 -6.34 4.72 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -15.44 59.69 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.63 -1.293 . . . . 0.0 110.929 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -73.01 -4.25 31.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -45.71 138.76 4.45 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 127.15 2.18 . . . . 0.0 111.06 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 101.77 -26.81 23.1 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.92 -18.62 8.16 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.402 1.081 . . . . 0.0 111.985 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -140.74 157.11 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -145.93 167.44 23.28 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 127.039 2.135 . . . . 0.0 107.767 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.18 162.46 5.86 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.258 0.623 . . . . 0.0 110.561 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.98 168.64 13.3 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.891 -0.506 . . . . 0.0 111.502 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -111.7 139.72 46.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.972 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.3 mp -68.82 -13.35 62.36 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 123.836 0.854 . . . . 0.0 111.019 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -60.27 -23.04 63.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.174 0.99 . . . . 0.0 111.943 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -71.47 -7.48 47.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.341 1.056 . . . . 0.0 110.99 -177.114 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 14.8 p90 . . . . . 0 N--CA 1.471 0.602 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 51.39 32.32 8.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.02 1.328 . . . . 0.0 111.799 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.4 p -71.27 171.06 11.77 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.522 1.929 . . . . 0.0 111.896 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.0 m -146.54 -31.71 0.34 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.555 1.542 . . . . 0.0 112.099 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.8 t60 53.83 15.87 0.92 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.515 1.526 . . . . 0.0 112.757 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -62.07 134.61 56.82 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.739 1.616 . . . . 0.0 109.624 -179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.48 157.59 37.76 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.734 1.213 . . . . 0.0 108.984 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -112.23 144.7 19.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -119.44 96.93 5.41 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -76.22 155.09 34.74 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.197 -2.149 . . . . 0.0 105.197 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -62.39 -33.33 74.55 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 74.41 123.95 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.919 2.088 . . . . 0.0 110.431 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.83 35.07 38.5 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.466 1.031 . . . . 0.0 113.533 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -140.17 -179.65 6.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.172 2.589 . . . . 0.0 109.335 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -72.67 -168.35 0.44 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.287 2.235 . . . . 0.0 111.27 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.277 22.0 p -79.21 118.18 20.91 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -176.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -169.28 140.5 2.36 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 126.781 2.032 . . . . 0.0 108.218 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.9 p90 -160.68 169.61 22.49 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.22 126.65 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 107.661 -1.236 . . . . 0.0 107.661 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -138.43 136.1 35.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.2 t0 55.16 41.39 31.59 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.011 1.325 . . . . 0.0 112.271 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 59.77 28.16 17.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.507 1.523 . . . . 0.0 111.644 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -130.95 142.76 50.38 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.403 1.081 . . . . 0.0 110.993 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.1 m -70.19 126.59 30.11 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.366 1.866 . . . . 0.0 107.767 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 5.5 m-85 -137.57 160.23 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.996 0.918 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 29' ' ' THR . 21.8 p90 -149.63 165.29 32.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.998 0.919 . . . . 0.0 109.007 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.5 t -94.65 128.64 45.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.916 -0.49 . . . . 0.0 109.779 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.499 HG23 ' CE2' ' A' ' 27' ' ' PHE . 17.6 p -96.27 166.47 11.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.001 1.32 . . . . 0.0 111.962 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -76.87 -10.03 59.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.021 1.328 . . . . 0.0 112.443 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -71.69 98.94 2.02 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.396 1.479 . . . . 0.0 108.038 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -89.98 142.92 27.24 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.12 140.87 26.2 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.963 1.705 . . . . 0.0 107.966 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.26 149.18 50.91 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.247 1.965 . . . . 0.0 109.909 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -57.71 -23.55 52.35 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -73.14 -23.67 60.5 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.931 -0.481 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.47 -14.82 39.4 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.654 1.182 . . . . 0.0 109.976 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.98 122.73 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.21 -61.51 1.79 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.09 168.35 13.72 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.931 1.292 . . . . 0.0 110.569 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.1 p -65.14 160.36 21.41 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.41 ' HE3' HD11 ' A' ' 82' ' ' LEU . 20.5 ttmm -128.21 -50.01 1.31 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 117.492 -1.242 . . . . 0.0 111.347 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -143.2 136.65 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 120.021 1.282 . . . . 0.0 111.691 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mtmm -104.24 114.83 29.34 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.613 1.965 . . . . 0.0 109.201 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -146.8 157.91 43.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 127.613 2.365 . . . . 0.0 108.988 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 108.29 5.65 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.274 0.943 . . . . 0.0 110.58 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.19 142.24 27.08 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.8 tt -135.15 145.27 47.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 127.979 2.512 . . . . 0.0 109.382 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.48 170.37 17.0 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.89 1.676 . . . . 0.0 108.755 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.98 136.73 59.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 125.49 1.516 . . . . 0.0 108.621 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -137.19 134.77 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.285 0.634 . . . . 0.0 109.956 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -79.81 125.35 29.59 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.403 1.081 . . . . 0.0 108.458 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 81.7 mtp -65.94 -16.22 63.67 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.965 1.257 . . . . 0.0 112.934 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -63.36 -53.79 47.03 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.094 0.861 . . . . 0.0 111.719 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 t -122.69 9.44 9.54 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 56.53 38.21 29.45 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.767 1.167 . . . . 0.0 110.085 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -105.86 143.03 34.58 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 125.223 1.409 . . . . 0.0 108.676 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.72 153.72 41.03 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.819 0.818 . . . . 0.0 111.092 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.7 mt -135.25 157.6 46.49 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.629 -1.168 . . . . 0.0 110.803 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.24 -20.88 33.7 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.815 1.246 . . . . 0.0 110.973 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 m -149.22 140.32 23.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.077 0.951 . . . . 0.0 108.454 -178.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.64 119.0 19.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.551 1.54 . . . . 0.0 110.404 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -107.28 172.0 7.07 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 126.329 1.852 . . . . 0.0 107.438 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -56.74 -26.45 57.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.717 1.376 . . . . 0.0 114.717 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -92.86 4.17 54.36 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.491 0.716 . . . . 0.0 111.754 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 43.0 t -117.62 166.69 12.1 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.569 1.548 . . . . 0.0 113.314 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.5 t -137.53 148.25 25.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 127.046 2.139 . . . . 0.0 106.545 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -101.91 143.4 31.85 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -130.86 136.82 49.0 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 t -116.04 101.96 12.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.72 96.7 9.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.915 1.286 . . . . 0.0 107.957 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.58 -161.76 0.25 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 118.41 0.55 . . . . 0.0 112.398 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 52.42 66.76 1.12 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.639 1.976 . . . . 0.0 112.281 176.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.3 mt -81.55 135.12 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.184 -0.948 . . . . 0.0 111.277 -178.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -139.36 161.97 36.15 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.637 1.975 . . . . 0.0 109.729 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -104.67 155.43 18.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.517 1.527 . . . . 0.0 108.606 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.59 163.92 12.82 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.419 1.887 . . . . 0.0 109.75 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.1 p -57.76 -34.2 69.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.378 0.671 . . . . 0.0 112.809 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -80.55 11.63 3.62 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.038 0.935 . . . . 0.0 110.582 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 71.19 12.04 6.83 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 127.878 2.471 . . . . 0.0 110.29 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.13 167.14 20.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.41 HD11 ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -119.12 148.4 43.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.637 1.175 . . . . 0.0 109.553 -178.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 17.5 p -147.2 167.23 24.72 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.476 0.71 . . . . 0.0 110.161 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.4 ttm -133.85 137.55 45.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 126.313 1.845 . . . . 0.0 108.198 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.54 121.2 5.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 125.298 1.428 . . . . 0.0 109.82 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.0 mt -136.72 120.62 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 51.42 51.22 17.26 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.586 1.954 . . . . 0.0 110.103 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t0 59.86 15.89 5.26 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.015 1.726 . . . . 0.0 114.134 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -121.09 139.18 53.67 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 125.266 1.426 . . . . 0.0 109.389 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -96.72 116.43 29.12 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 118.331 0.514 . . . . 0.0 111.391 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -106.89 125.84 51.53 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.26 1.424 . . . . 0.0 109.491 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -60.71 146.32 46.22 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.155 0.982 . . . . 0.0 109.697 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.3 pt -115.9 132.93 63.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -129.19 165.16 34.34 Favored Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 124.713 1.205 . . . . 0.0 112.33 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.96 148.81 32.14 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.819 2.346 . . . . 0.0 110.176 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -58.65 -15.32 11.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.404 0.682 . . . . 0.0 112.703 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.2 m -72.66 -14.91 61.69 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 120.762 -1.211 . . . . 0.0 112.055 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.42 -4.07 43.48 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.799 -1.188 . . . . 0.0 111.445 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -53.96 150.24 8.07 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.994 1.318 . . . . 0.0 108.941 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.6 1.81 63.7 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -148.86 -49.89 0.15 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.018 2.527 . . . . 0.0 106.259 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 t -109.3 161.51 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.152 0.981 . . . . 0.0 109.068 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -150.67 170.51 19.01 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 127.097 2.159 . . . . 0.0 108.864 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.62 169.11 2.54 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.203 1.001 . . . . 0.0 112.174 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.31 174.94 9.57 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.587 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.1 mtt85 -125.12 141.69 51.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 O-C-N 121.887 -0.508 . . . . 0.0 110.79 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.468 HD13 ' H ' ' A' ' 107' ' ' LEU . 0.4 OUTLIER -63.12 -22.04 66.59 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.312 1.045 . . . . 0.0 110.936 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -57.29 -16.57 8.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -76.77 -3.11 36.52 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.336 0.655 . . . . 0.0 110.495 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.253 1.252 0 C-N-CA 127.719 2.408 . . . . 0.0 107.729 -178.987 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 30.8 t80 . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -91.12 167.48 12.33 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.217 1.372 . . . . 0.0 109.958 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.6 p -138.24 -13.82 1.35 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.105 1.362 . . . . 0.0 112.573 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.8 m -81.38 151.8 27.77 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.71 1.204 . . . . 0.0 110.457 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -135.05 158.42 44.4 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.985 1.714 . . . . 0.0 106.664 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -139.36 153.76 47.73 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.093 1.357 . . . . 0.0 108.668 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? -67.54 137.23 55.58 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -104.07 130.45 54.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -98.23 111.94 24.09 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -87.04 158.88 19.13 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.85 -33.93 75.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 75.2 128.11 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.352 2.261 . . . . 0.0 112.348 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.99 34.83 39.32 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 125.737 1.637 . . . . 0.0 112.249 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.9 m -139.89 178.47 7.23 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 125.928 1.691 . . . . 0.0 112.096 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -73.65 -169.45 0.7 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.116 1.767 . . . . 0.0 108.764 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.6 p -79.67 120.88 24.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 119.658 -1.901 . . . . 0.0 110.574 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -168.23 144.41 3.84 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 130.172 3.389 . . . . 0.0 106.596 178.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 31.7 p90 -165.79 165.43 18.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.5 mp -120.57 131.3 73.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 123.784 0.834 . . . . 0.0 109.148 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -144.45 143.91 31.12 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 50.64 34.31 9.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 112.638 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 58.01 33.52 23.28 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 112.384 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -130.61 146.3 52.09 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.062 1.745 . . . . 0.0 106.864 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 m -74.44 140.81 44.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.8 m-85 -139.54 159.23 42.65 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 125.643 1.577 . . . . 0.0 109.523 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -148.91 165.69 30.8 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.021 -1.05 . . . . 0.0 109.799 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.9 t -101.26 128.24 53.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 p -99.71 172.39 7.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.356 1.462 . . . . 0.0 109.05 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -78.05 -15.58 58.79 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.624 1.97 . . . . 0.0 112.273 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -67.31 116.33 7.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.514 1.126 . . . . 0.0 110.681 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.24 148.26 23.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.969 1.708 . . . . 0.0 111.47 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 23.6 mm -116.4 127.77 26.5 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 126.594 1.958 . . . . 0.0 109.419 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.63 146.74 68.25 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.7 2.267 . . . . 0.0 109.477 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -55.93 -27.64 53.2 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.6 -23.78 67.52 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.535 0.734 . . . . 0.0 111.574 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -95.12 -19.07 20.41 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.63 139.21 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.456 ' ND2' HD21 ' A' ' 40' ' ' ASN . 0.2 OUTLIER -93.36 -60.94 1.66 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.258 -179.685 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.456 HD21 ' ND2' ' A' ' 39' ' ' ASN . 6.7 p30 -163.43 166.04 23.22 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.65 0.78 . . . . 0.0 111.668 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 p -70.76 126.74 30.42 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -101.51 -42.16 6.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 55.3 t -142.64 127.95 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 119.105 0.866 . . . . 0.0 108.877 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -100.38 117.37 34.43 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -149.93 157.08 42.82 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 131.282 3.833 . . . . 0.0 105.197 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -137.21 115.39 11.67 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 104.052 -2.574 . . . . 0.0 104.052 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -146.77 133.52 20.01 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.6 tt -137.58 145.63 43.08 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.876 1.67 . . . . 0.0 108.215 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.88 169.31 25.06 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 125.909 1.683 . . . . 0.0 106.48 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.5 mt -127.97 137.41 57.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 C-N-CA 125.617 1.567 . . . . 0.0 107.111 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -130.55 140.22 49.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.71 126.98 33.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 84.2 mtp -67.62 -18.69 65.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -72.22 -44.61 62.67 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -122.13 0.84 9.68 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.61 30.28 18.56 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.885 1.274 . . . . 0.0 111.068 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -99.05 147.05 25.43 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.88 0.872 . . . . 0.0 110.0 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.91 146.95 43.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mp -124.43 177.58 5.83 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.379 1.472 . . . . 0.0 110.397 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 t -116.9 -3.25 11.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.978 1.311 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 p -144.7 162.34 36.96 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 120.219 1.372 . . . . 0.0 109.129 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.8 t -92.76 115.4 28.08 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -124.44 161.59 25.71 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -56.45 -19.93 17.49 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -93.08 -4.33 52.58 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.92 0.888 . . . . 0.0 110.753 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 m -113.7 160.09 19.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.484 1.514 . . . . 0.0 113.771 -176.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 25.3 t -137.07 146.59 27.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 125.191 1.397 . . . . 0.0 108.826 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -85.75 141.37 29.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -129.98 100.75 5.56 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 105.887 -1.894 . . . . 0.0 105.887 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.87 102.41 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 103.203 -2.888 . . . . 0.0 103.203 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.32 93.71 8.35 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.656 -0.418 . . . . 0.0 112.005 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 47.1 67.38 0.8 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.012 1.725 . . . . 0.0 111.723 177.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.2 mt -77.45 140.12 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.538 -1.351 . . . . 0.0 109.591 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -134.15 169.67 16.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.753 2.021 . . . . 0.0 111.01 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -113.06 170.8 7.95 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.017 2.127 . . . . 0.0 109.601 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.61 161.24 26.67 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.747 2.019 . . . . 0.0 108.272 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -60.57 -26.88 67.27 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.504 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -93.53 28.49 2.27 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.49 1.916 . . . . 0.0 111.32 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 59.35 3.19 0.36 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.328 1.851 . . . . 0.0 112.93 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.7 m -73.49 152.86 40.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.49 150.09 35.37 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.297 0.639 . . . . 0.0 110.773 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.0 p -144.69 169.44 18.0 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.901 0.88 . . . . 0.0 110.619 178.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.0 ttm -134.46 136.24 43.06 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 126.391 1.876 . . . . 0.0 109.328 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.48 110.38 3.28 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 125.502 1.525 . . . . 0.0 111.439 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.2 mt -123.68 119.16 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 49.49 51.81 15.69 Favored 'General case' 0 C--O 1.23 0.076 0 C-N-CA 124.689 1.195 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 70.31 -6.22 1.2 Allowed 'General case' 0 C--O 1.24 0.561 0 C-N-CA 128.046 2.538 . . . . 0.0 115.525 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -105.41 133.74 49.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.396 1.453 . . . . 0.0 110.646 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -85.67 116.66 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.455 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -115.85 132.53 56.61 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.504 1.122 . . . . 0.0 112.219 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -60.53 142.38 55.41 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.833 1.253 . . . . 0.0 111.19 -179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.7 135.5 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -130.18 159.3 71.01 Favored Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 123.954 0.902 . . . . 0.0 108.818 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.0 161.18 45.32 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.312 2.008 . . . . 0.0 109.831 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.17 -13.07 32.77 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 110.472 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -63.34 -24.36 67.82 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.216 1.806 . . . . 0.0 109.555 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -10.69 59.99 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.828 1.251 . . . . 0.0 111.183 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.9 mmtt -59.26 161.49 5.42 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 120.682 -1.261 . . . . 0.0 109.941 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.7 -35.11 4.18 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -124.15 -5.92 7.81 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.3 t -135.51 156.81 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 126.515 1.926 . . . . 0.0 105.863 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -138.6 165.45 26.87 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.892 1.677 . . . . 0.0 108.131 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.88 166.42 15.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.02 167.31 10.04 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -106.89 132.29 53.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 125.886 1.674 . . . . 0.0 110.474 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mt -67.38 -21.41 65.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.311 0.644 . . . . 0.0 109.984 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -60.07 -20.42 58.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.901 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -67.09 -16.93 64.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.97 0.804 . . . . 0.0 112.293 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.691 1.996 . . . . 0.0 111.33 -177.387 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -130.32 151.6 50.65 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.202 0.601 . . . . 0.0 109.925 179.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.8 t -128.24 -6.9 5.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.71 166.7 5.16 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-N 118.943 0.792 . . . . 0.0 109.539 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -49.31 156.17 0.62 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -127.86 8.58 6.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.433 1.493 . . . . 0.0 111.832 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -60.13 128.16 35.44 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.7 t -64.44 143.71 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 O-C-N 121.825 -0.547 . . . . 0.0 110.183 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -117.12 105.6 12.44 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -84.63 153.61 23.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -67.18 -33.96 76.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.571 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 63.31 135.62 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.93 3.292 . . . . 0.0 112.408 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.95 24.35 74.4 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m -138.83 178.64 7.01 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.706 2.002 . . . . 0.0 112.286 -178.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.44 -169.02 0.6 Allowed 'General case' 0 C--O 1.24 0.599 0 C-N-CA 129.096 2.958 . . . . 0.0 107.694 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.258 35.2 p -79.32 119.39 22.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 117.534 -1.666 . . . . 0.0 108.324 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -169.2 147.74 3.83 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 130.212 3.405 . . . . 0.0 107.033 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -168.13 171.41 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 126.351 1.86 . . . . 0.0 107.979 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -126.68 127.74 70.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -141.08 147.24 38.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.9 t70 54.92 32.15 17.35 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.252 1.821 . . . . 0.0 109.691 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 66.64 15.56 10.15 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 127.576 2.35 . . . . 0.0 113.357 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -123.66 154.77 38.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 124.395 1.078 . . . . 0.0 109.588 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.1 t -79.34 141.93 36.52 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -144.59 155.78 43.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.711 2.004 . . . . 0.0 111.493 -178.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -148.8 151.23 34.42 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 120.904 -1.122 . . . . 0.0 110.529 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 t -81.11 127.96 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 123.997 0.919 . . . . 0.0 110.626 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.3 p -98.14 164.4 12.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.803 1.241 . . . . 0.0 109.035 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.68 -12.37 61.3 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 126.506 1.922 . . . . 0.0 113.295 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.95 112.31 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.584 1.553 . . . . 0.0 109.208 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -96.83 146.92 24.46 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.719 0.808 . . . . 0.0 109.451 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -114.04 135.22 22.08 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.604 1.962 . . . . 0.0 109.139 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.3 151.58 29.88 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.452 2.768 . . . . 0.0 111.564 178.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -58.5 -22.6 55.59 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.528 0.731 . . . . 0.0 112.749 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -67.45 -25.84 66.1 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.937 -0.477 . . . . 0.0 110.517 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -90.63 -20.01 23.02 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 111.399 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.1 t -65.13 126.15 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.444 ' ND2' HD21 ' A' ' 40' ' ' ASN . 0.2 OUTLIER -83.47 -61.3 1.88 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.733 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.444 HD21 ' ND2' ' A' ' 39' ' ' ASN . 4.5 p30 -163.87 168.95 18.86 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 126.159 1.783 . . . . 0.0 109.16 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.442 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 15.9 m -63.16 155.35 28.36 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.155 0.982 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -120.42 -54.73 2.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.737 -0.602 . . . . 0.0 110.592 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.2 t -146.99 146.81 18.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.58 125.38 53.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 104.047 -2.575 . . . . 0.0 104.047 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 158.43 44.06 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 126.274 1.83 . . . . 0.0 111.343 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.87 112.83 15.15 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.571 ' HE3' ' CD2' ' A' ' 49' ' ' LEU . 4.0 tmtm? -147.99 115.9 6.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.45 1.1 . . . . 0.0 109.113 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -131.78 134.77 46.2 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.112 1.365 . . . . 0.0 107.823 178.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.571 ' CD2' ' HE3' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -148.53 170.97 16.88 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.853 1.661 . . . . 0.0 108.425 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -129.28 129.6 67.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.5 t -120.93 134.03 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.67 1.188 . . . . 0.0 108.966 -178.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -80.68 126.03 30.77 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.03 -1.043 . . . . 0.0 109.574 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 76.5 mtp -68.23 -17.79 64.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.608 1.549 . . . . 0.0 113.808 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -65.0 -52.03 58.37 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.164 0.893 . . . . 0.0 111.094 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -122.19 6.25 9.71 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 60.66 24.79 14.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.484 1.514 . . . . 0.0 112.353 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -93.27 151.15 19.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 120.931 -1.106 . . . . 0.0 109.157 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.8 146.21 49.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.6 mt -130.42 -179.59 5.35 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.328 2.251 . . . . 0.0 108.253 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.8 m -131.78 -5.06 3.62 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.693 1.197 . . . . 0.0 112.281 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -123.71 174.63 7.36 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.041 1.736 . . . . 0.0 106.963 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 t -109.28 110.44 21.63 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.262 87.5 m-20 -102.65 159.38 15.51 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.355 1.462 . . . . 0.0 107.747 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -70.52 -12.87 61.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.211 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -100.62 5.52 43.9 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.439 1.472 . . . . 0.0 110.55 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.7 t -113.78 173.75 6.27 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.012 1.725 . . . . 0.0 112.053 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.5 t -142.59 130.41 19.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 125.731 1.612 . . . . 0.0 107.784 178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -75.04 135.09 41.27 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -125.84 132.33 52.24 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 120.8 -1.187 . . . . 0.0 108.332 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -113.31 107.84 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.53 92.04 3.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.909 1.232 . . . . 0.0 110.981 -178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.14 -164.34 0.53 Allowed 'General case' 0 CA--C 1.508 -0.672 0 O-C-N 121.199 -0.938 . . . . 0.0 111.736 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.94 66.79 0.87 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 123.882 0.739 . . . . 0.0 111.636 176.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 6.7 mt -79.61 138.61 19.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.442 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.3 m-85 -134.69 168.83 18.3 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.13 1.772 . . . . 0.0 107.768 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -110.9 157.9 19.34 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.486 1.514 . . . . 0.0 108.141 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.77 162.59 17.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 125.348 1.459 . . . . 0.0 109.457 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.1 t -56.42 -29.98 62.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.486 0.714 . . . . 0.0 111.098 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -85.08 12.29 8.04 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.82 -1.175 . . . . 0.0 112.517 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm 75.3 1.99 3.79 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.546 1.939 . . . . 0.0 110.462 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 m -74.72 167.69 21.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.439 1.096 . . . . 0.0 110.108 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.78 148.58 45.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.492 1.117 . . . . 0.0 110.204 -178.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.4 p -140.2 171.07 14.69 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.08 0.952 . . . . 0.0 109.414 178.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.5 ttm -131.36 134.65 46.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.357 1.863 . . . . 0.0 110.718 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.24 103.78 2.53 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 126.743 2.116 . . . . 0.0 110.573 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 65.7 mt -117.43 113.97 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.899 1.68 . . . . 0.0 108.074 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 47.84 54.01 10.57 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 124.743 1.217 . . . . 0.0 112.585 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 75.21 -4.64 2.33 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.518 1.927 . . . . 0.0 115.473 178.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -115.85 147.48 40.99 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.378 1.445 . . . . 0.0 109.626 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -99.85 116.92 33.04 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -108.09 133.44 52.37 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.964 1.305 . . . . 0.0 111.176 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -67.87 151.09 47.72 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.19 -0.944 . . . . 0.0 110.059 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -118.58 133.66 64.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -119.59 156.75 53.25 Favored Pre-proline 0 N--CA 1.467 0.39 0 C-N-CA 125.238 1.415 . . . . 0.0 108.848 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.51 156.1 64.93 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.483 2.122 . . . . 0.0 109.888 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.36 65.18 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.577 -0.702 . . . . 0.0 109.68 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.0 t -70.88 -0.7 9.71 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.107 0.963 . . . . 0.0 110.516 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.97 -3.77 31.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.033 -1.667 . . . . 0.0 112.959 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -53.05 164.41 0.41 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.606 1.193 . . . . 0.0 112.701 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.62 -41.77 3.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 125.118 1.342 . . . . 0.0 111.823 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.75 -28.24 19.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.417 1.087 . . . . 0.0 110.573 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.9 p -134.02 162.9 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 127.38 2.272 . . . . 0.0 106.402 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -134.39 172.56 12.72 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.818 2.447 . . . . 0.0 106.875 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.68 168.71 14.3 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.23 172.51 6.85 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.711 -0.618 . . . . 0.0 112.46 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -118.22 138.88 52.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.341 1.056 . . . . 0.0 110.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -70.85 -13.13 61.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.162 0.585 . . . . 0.0 110.04 179.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -61.48 -10.13 7.11 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.243 2.217 . . . . 0.0 113.18 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -96.1 -4.65 42.45 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.726 0.81 . . . . 0.0 112.706 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 C--O 1.25 1.099 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.226 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 17.4 t80 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 117.643 -1.17 . . . . 0.0 113.064 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -106.55 33.95 3.64 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.682 1.583 . . . . 0.0 112.335 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.7 m -69.95 128.23 35.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.609 -1.307 . . . . 0.0 113.032 -178.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 t -161.48 160.46 29.24 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.521 1.529 . . . . 0.0 108.405 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -152.8 110.87 3.65 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.098 1.359 . . . . 0.0 109.065 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -137.91 160.45 39.29 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.268 1.427 . . . . 0.0 107.468 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -64.24 162.21 15.08 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.2 t -99.13 137.15 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -102.46 103.05 13.4 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 103.688 -2.708 . . . . 0.0 103.688 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -80.59 166.63 20.94 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.493 1.117 . . . . 0.0 110.697 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -59.24 -33.58 71.18 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.709 1.604 . . . . 0.0 113.798 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 51.19 91.96 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.101 2.56 . . . . 0.0 113.477 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 65.07 38.7 95.67 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 113.748 -1.569 . . . . 0.0 111.904 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.0 m -139.38 -179.89 6.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.349 2.259 . . . . 0.0 109.647 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.66 -170.07 0.8 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.617 1.567 . . . . 0.0 108.358 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 33.8 p -79.49 121.76 25.6 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 123.994 1.854 . . . . 0.0 110.438 -175.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -167.14 149.42 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 129.584 3.154 . . . . 0.0 107.234 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -164.27 167.27 20.11 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -131.53 112.83 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 O-C-N 120.452 -1.405 . . . . 0.0 108.278 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -117.55 137.07 52.83 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.067 0.947 . . . . 0.0 108.608 178.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.3 t70 55.25 34.22 22.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.175 1.79 . . . . 0.0 114.042 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 69.78 17.65 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.844 2.458 . . . . 0.0 111.933 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -119.08 138.24 53.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.963 1.705 . . . . 0.0 106.944 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.2 m -82.42 136.95 34.83 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -137.67 166.41 24.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.561 1.944 . . . . 0.0 112.125 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -148.99 163.66 36.86 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.495 0.718 . . . . 0.0 110.725 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 t -96.01 122.52 47.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 124.785 1.234 . . . . 0.0 108.466 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.78 172.82 7.01 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.517 1.127 . . . . 0.0 110.009 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -74.9 -14.98 60.71 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 110.95 5.03 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.065 0.946 . . . . 0.0 110.315 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.19 146.81 24.38 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.36 1.064 . . . . 0.0 108.524 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.71 137.17 24.02 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 126.528 1.931 . . . . 0.0 105.946 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.6 153.05 49.02 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.447 2.098 . . . . 0.0 111.47 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.21 -30.19 64.36 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -65.9 -15.6 63.09 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.783 0.719 . . . . 0.0 112.686 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -97.9 -14.44 20.67 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.988 0.915 . . . . 0.0 111.14 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.9 t -78.23 135.35 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 C-N-CA 124.602 1.161 . . . . 0.0 108.001 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.66 -61.34 1.66 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.359 1.464 . . . . 0.0 111.038 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -156.23 158.71 38.01 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.7 t -70.45 131.43 44.04 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttp -101.12 -51.93 3.4 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 117.153 -1.403 . . . . 0.0 114.535 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.9 t -141.39 133.48 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 119.027 0.831 . . . . 0.0 110.191 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.21 117.2 33.43 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.335 1.054 . . . . 0.0 109.445 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -148.77 157.44 43.44 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.628 1.971 . . . . 0.0 110.128 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -123.3 120.71 33.88 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.963 -1.085 . . . . 0.0 108.398 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.4 tptm -147.51 124.02 11.05 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.725 1.21 . . . . 0.0 107.818 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 tt -134.19 143.96 48.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.623 1.969 . . . . 0.0 109.407 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -153.72 169.57 23.0 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 125.369 1.468 . . . . 0.0 107.838 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mt -130.33 133.82 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 125.192 1.397 . . . . 0.0 107.443 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.19 152.49 33.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 125.738 1.615 . . . . 0.0 108.129 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -88.89 124.83 34.58 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.347 1.859 . . . . 0.0 107.327 178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.9 mtp -68.35 -25.95 65.35 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 121.009 1.731 . . . . 0.0 109.863 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -53.56 54.09 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.362 1.065 . . . . 0.0 112.677 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -111.34 -6.14 14.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 65.0 20.2 12.05 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.819 1.19 . . . . 0.0 111.308 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -102.27 153.89 19.55 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.79 1.636 . . . . 0.0 108.637 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.77 154.59 39.51 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.335 0.516 . . . . 0.0 111.393 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.2 mt -135.56 160.28 38.98 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 125.791 1.636 . . . . 0.0 108.809 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -7.98 45.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.4 m -142.18 165.57 27.08 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.737 1.608 . . . . 0.0 110.071 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.4 p -92.39 117.01 29.48 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -132.23 163.06 29.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -47.38 -34.59 7.2 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -80.08 -7.1 58.71 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.829 -1.169 . . . . 0.0 112.634 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.8 t -120.55 164.28 16.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 127.346 2.258 . . . . 0.0 114.035 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -137.32 161.38 34.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 127.012 2.125 . . . . 0.0 106.353 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.1 t -110.87 144.84 39.29 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.016 1.327 . . . . 0.0 109.487 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.1 mt -131.19 144.72 51.56 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.0 t -122.94 101.73 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 101.658 -3.46 . . . . 0.0 101.658 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -87.87 96.07 10.34 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -178.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.01 -161.62 0.33 Allowed 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.59 66.93 1.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.639 1.576 . . . . 0.0 111.455 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 mt -79.36 137.1 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.166 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -134.99 168.86 18.34 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.967 1.707 . . . . 0.0 109.212 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -116.96 147.1 42.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.31 168.47 10.0 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 126.251 1.82 . . . . 0.0 110.637 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.9 t -60.31 -35.15 74.93 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -83.15 18.2 1.78 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.986 1.314 . . . . 0.0 112.178 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 65.26 12.5 8.09 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.256 1.422 . . . . 0.0 110.43 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.8 t -81.29 169.29 17.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.4 mt -123.55 154.99 38.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.413 0.685 . . . . 0.0 112.377 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.4 p -146.98 171.78 14.72 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.901 0.88 . . . . 0.0 110.035 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.2 ttm -133.58 135.98 44.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.368 1.867 . . . . 0.0 108.651 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.0 115.74 4.17 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 126.174 1.845 . . . . 0.0 112.865 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -132.76 122.84 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 55.7 36.92 28.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.39 1.876 . . . . 0.0 110.777 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 t0 70.02 13.82 7.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.14 2.176 . . . . 0.0 114.173 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -116.48 138.54 51.3 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.843 1.657 . . . . 0.0 107.823 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -91.2 116.88 29.17 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.798 -0.564 . . . . 0.0 110.448 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -106.07 124.56 49.77 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.224 1.409 . . . . 0.0 107.597 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.1 ttpp -60.53 157.51 14.1 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.157 -0.964 . . . . 0.0 111.307 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pt -121.99 134.54 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.01 158.74 67.87 Favored Pre-proline 0 N--CA 1.469 0.484 0 C-N-CA 125.093 1.357 . . . . 0.0 107.877 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.08 153.69 67.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.161 1.907 . . . . 0.0 109.171 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.53 -19.79 66.07 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 119.892 -0.723 . . . . 0.0 110.747 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -63.82 -19.46 65.04 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.266 1.426 . . . . 0.0 110.894 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -84.88 2.17 43.84 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmt -55.5 154.6 6.25 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.883 0.765 . . . . 0.0 110.033 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.76 -21.72 35.7 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.078 0.847 . . . . 0.0 111.83 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.15 -12.43 6.91 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 118.86 1.33 . . . . 0.0 111.182 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -141.35 155.86 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 C-N-CA 125.655 1.582 . . . . 0.0 107.286 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -130.06 164.73 23.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.999 1.72 . . . . 0.0 108.211 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 164.6 12.99 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.48 160.0 11.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.386 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -107.35 133.18 52.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 124.217 1.007 . . . . 0.0 111.275 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.47 -23.06 67.15 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.759 1.224 . . . . 0.0 110.041 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.11 -9.2 2.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.042 1.337 . . . . 0.0 113.664 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -84.43 -8.04 59.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.18 0.992 . . . . 0.0 111.053 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 C--O 1.245 0.86 0 C-N-CA 124.367 1.067 . . . . 0.0 111.17 -176.602 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.0 p90 . . . . . 0 N--CA 1.468 0.434 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -67.01 139.74 57.68 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.871 -1.899 . . . . 0.0 105.871 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 t -133.89 3.27 3.47 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -76.83 47.03 0.49 Allowed 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.665 1.121 . . . . 0.0 111.094 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -79.81 61.29 3.7 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.821 1.648 . . . . 0.0 107.291 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -106.69 167.32 9.95 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 125.8 1.64 . . . . 0.0 106.699 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.94 154.55 30.02 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.519 -0.738 . . . . 0.0 110.494 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.6 t -102.47 115.75 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 102.476 -3.157 . . . . 0.0 102.476 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -80.49 113.75 18.89 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.24 150.5 25.41 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -71.56 -34.05 69.63 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 119.636 -0.826 . . . . 0.0 111.358 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 66.51 137.44 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 128.174 2.59 . . . . 0.0 112.508 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.9 26.04 39.61 Favored Glycine 0 CA--C 1.533 1.172 0 O-C-N 121.294 -0.879 . . . . 0.0 113.202 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 m -140.26 177.68 7.82 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.519 1.928 . . . . 0.0 111.291 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.06 -168.33 0.61 Allowed 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.564 2.345 . . . . 0.0 107.025 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -79.85 121.87 25.95 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.781 -1.824 . . . . 0.0 110.113 -176.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -167.26 146.68 5.2 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 130.792 3.637 . . . . 0.0 105.646 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -168.79 167.4 11.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.259 1.424 . . . . 0.0 108.226 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.5 mt -130.92 113.22 23.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 O-C-N 121.595 -0.691 . . . . 0.0 109.251 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -120.01 139.98 51.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 53.27 33.2 14.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 123.029 1.395 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 56.84 30.14 17.32 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.034 2.534 . . . . 0.0 111.632 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.9 mtpp -123.16 132.37 54.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.682 1.993 . . . . 0.0 105.634 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.5 p -71.45 139.67 49.73 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -145.66 163.08 35.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.156 1.782 . . . . 0.0 109.385 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 p90 -149.14 162.02 40.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -95.75 127.04 48.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -96.57 171.86 8.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.693 1.597 . . . . 0.0 110.574 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.42 -10.25 59.35 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.542 1.937 . . . . 0.0 112.41 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.09 103.55 1.56 Allowed 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 126.081 1.752 . . . . 0.0 110.173 -179.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -94.29 142.25 27.63 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.21 142.63 29.62 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 124.331 1.052 . . . . 0.0 109.389 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -77.9 150.62 27.05 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.649 2.899 . . . . 0.0 110.408 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -54.37 -29.99 50.39 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -63.36 -19.96 65.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.264 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -97.69 -14.05 21.12 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.417 0.553 . . . . 0.0 111.749 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.62 119.84 25.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.24 -61.49 1.97 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.394 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.56 173.74 15.06 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.074 0.95 . . . . 0.0 110.809 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.5 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -63.21 163.47 10.24 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.7 1.2 . . . . 0.0 111.452 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.1 -53.19 0.85 Allowed 'General case' 0 CA--C 1.518 -0.261 0 O-C-N 121.075 -1.016 . . . . 0.0 109.241 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -144.68 132.33 16.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -108.46 92.65 4.14 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.541 1.162 . . . . 0.0 109.569 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -132.09 156.49 46.23 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 128.345 2.658 . . . . 0.0 105.738 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -134.94 118.3 16.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.494 1.918 . . . . 0.0 108.281 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.71 137.62 24.04 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -134.63 145.58 48.74 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.641 1.977 . . . . 0.0 107.839 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -151.54 170.29 20.01 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 107.302 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.5 mt -127.5 128.79 70.17 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.154 0 C-N-CA 123.316 0.646 . . . . 0.0 109.329 -177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.78 137.09 51.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 125.464 1.506 . . . . 0.0 110.554 -178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.88 117.04 23.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 129.284 3.034 . . . . 0.0 111.784 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 70.3 mtp -68.2 -14.49 63.02 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.683 -1.261 . . . . 0.0 112.247 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -69.74 -53.32 18.96 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.827 -1.17 . . . . 0.0 111.53 178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.8 m -122.79 10.53 9.6 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 58.95 21.08 8.82 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.178 1.391 . . . . 0.0 112.873 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 mtmm -96.81 161.73 13.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 123.742 0.817 . . . . 0.0 110.59 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.95 153.61 24.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.1 mt -135.18 160.93 36.8 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.696 1.198 . . . . 0.0 110.437 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -78.84 -25.8 44.11 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.04 0.536 . . . . 0.0 110.4 177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.27 158.66 43.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.505 1.122 . . . . 0.0 108.906 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.09 116.5 27.41 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.78 173.84 9.18 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -63.23 -18.59 63.7 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.137 -0.977 . . . . 0.0 112.238 177.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -103.6 18.18 22.45 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.458 1.503 . . . . 0.0 109.758 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.34 158.57 33.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.246 1.818 . . . . 0.0 108.609 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.0 t -133.31 145.58 33.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 125.068 1.347 . . . . 0.0 107.572 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -93.7 137.23 33.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.66 136.25 49.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 t -107.58 103.35 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 102.998 -2.964 . . . . 0.0 102.998 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -95.9 92.19 6.39 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 -166.06 0.89 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 51.67 67.49 0.95 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 122.557 1.17 . . . . 0.0 112.314 176.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.83 134.35 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.984 -1.073 . . . . 0.0 109.957 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.5 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 40.9 m-85 -135.16 169.86 16.8 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.735 2.014 . . . . 0.0 110.452 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -112.93 159.79 18.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.144 2.178 . . . . 0.0 109.866 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.76 169.56 9.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.218 1.407 . . . . 0.0 110.593 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -25.36 63.49 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.44 0.696 . . . . 0.0 112.011 179.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -98.8 15.15 26.32 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.09 -1.006 . . . . 0.0 112.338 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp 71.69 2.32 4.24 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.969 1.708 . . . . 0.0 112.617 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.7 m -70.28 159.36 34.2 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -114.04 156.66 23.71 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.26 -0.9 . . . . 0.0 111.046 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -143.77 170.96 14.89 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.158 0.983 . . . . 0.0 110.088 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.5 ttm -134.59 137.37 43.68 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 126.618 1.967 . . . . 0.0 108.982 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.86 124.11 6.38 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 126.194 1.854 . . . . 0.0 109.98 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.5 mt -144.18 120.87 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 53.1 45.5 28.58 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.545 0.738 . . . . 0.0 110.843 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.6 t0 60.33 17.65 7.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.52 1.928 . . . . 0.0 113.995 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.1 137.48 54.91 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 126.27 1.828 . . . . 0.0 108.269 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.58 116.99 29.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 122.488 0.315 . . . . 0.0 110.773 -178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -106.19 125.78 51.42 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.288 1.435 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -62.66 145.35 54.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.713 0.805 . . . . 0.0 110.75 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.76 133.01 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 106.079 -1.823 . . . . 0.0 106.079 179.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -124.99 156.57 69.03 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.557 1.143 . . . . 0.0 109.777 -178.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.08 141.64 33.09 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 N-CA-C 107.301 -1.846 . . . . 0.0 107.301 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -58.96 -13.75 7.31 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.7 t -68.8 -16.35 63.77 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.65 -6.2 54.87 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 119.638 1.108 . . . . 0.0 113.473 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -56.03 157.69 4.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.886 0.851 . . . . 0.0 109.719 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.93 -23.5 35.75 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 108.353 -1.899 . . . . 0.0 108.353 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.95 -7.35 13.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.004 2.121 . . . . 0.0 109.393 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 p -156.98 158.01 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 129.083 2.953 . . . . 0.0 105.242 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -135.6 170.66 15.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.979 1.712 . . . . 0.0 106.732 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.1 162.74 11.14 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.541 0.686 . . . . 0.0 110.979 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.17 163.2 3.87 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.498 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 40.9 mtm180 -116.48 139.14 50.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 124.289 1.036 . . . . 0.0 111.684 -177.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.51 -19.62 62.17 Favored 'General case' 0 C--O 1.22 -0.464 0 O-C-N 123.963 0.789 . . . . 0.0 110.797 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.2 -2.88 2.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.417 1.887 . . . . 0.0 113.158 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -93.71 0.57 56.47 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.039 -1.038 . . . . 0.0 110.003 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 125.049 1.339 . . . . 0.0 110.906 -178.046 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 42.7 p90 . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 118.038 -0.982 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.84 141.19 57.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.859 1.663 . . . . 0.0 108.146 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.2 p -141.87 108.79 5.43 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 118.624 0.647 . . . . 0.0 110.678 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 t -164.35 164.35 22.23 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -52.97 -38.25 61.96 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.248 1.019 . . . . 0.0 111.989 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt 44.29 54.89 5.9 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.782 1.633 . . . . 0.0 110.308 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -46.21 118.73 2.02 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.356 1.062 . . . . 0.0 109.221 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -81.23 138.17 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 124.523 1.129 . . . . 0.0 108.213 -178.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -106.6 133.32 51.46 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -102.55 161.12 13.97 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -66.31 -32.89 74.56 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 64.93 137.85 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 128.627 2.771 . . . . 0.0 112.851 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.34 28.83 44.64 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 t -139.97 178.35 7.32 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.106 2.162 . . . . 0.0 110.923 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.59 -169.49 0.7 Allowed 'General case' 0 C--O 1.246 0.89 1 C-N-CA 132.02 4.128 . . . . 0.0 107.867 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.9 p -80.61 118.84 22.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 116.956 -1.897 . . . . 0.0 108.682 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -169.13 144.95 3.31 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 130.677 3.591 . . . . 0.0 105.676 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.4 p90 -165.49 177.86 7.15 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.555 1.142 . . . . 0.0 108.926 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.9 mt -133.86 125.76 49.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -139.06 140.74 38.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.371 1.468 . . . . 0.0 108.564 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t0 48.52 40.88 16.11 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.243 2.217 . . . . 0.0 113.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.9 m120 67.77 22.96 8.7 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 127.797 2.439 . . . . 0.0 114.042 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 mtpp -130.55 152.8 49.53 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.166 0.986 . . . . 0.0 109.185 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.2 t -79.19 143.39 35.44 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.3 m-85 -147.19 161.08 41.64 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 122.727 0.411 . . . . 0.0 111.248 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -148.7 159.6 43.96 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.583 0.753 . . . . 0.0 109.453 178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.0 t -92.49 127.79 44.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.1 p -99.47 171.98 7.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.004 0.906 . . . . 0.0 110.91 -178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -76.36 -5.69 48.29 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 127.11 2.164 . . . . 0.0 113.1 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -81.46 104.14 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 124.327 1.051 . . . . 0.0 109.614 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -92.03 140.85 29.24 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -117.13 135.47 23.1 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 -179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.83 152.6 68.97 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.097 2.531 . . . . 0.0 111.205 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.37 -26.08 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 122.008 -0.432 . . . . 0.0 110.992 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -66.58 -19.5 65.79 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.59 -0.694 . . . . 0.0 112.044 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -96.55 -14.77 22.02 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.066 1.746 . . . . 0.0 111.028 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.3 t -67.5 139.11 21.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.06 -54.18 4.35 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.151 1.38 . . . . 0.0 110.807 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.06 169.33 6.61 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.314 1.446 . . . . 0.0 110.892 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.6 p -65.55 161.09 20.96 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.274 1.83 . . . . 0.0 109.466 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -130.62 -56.05 1.07 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.573 -1.203 . . . . 0.0 112.306 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.9 t -148.79 143.73 18.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 119.194 0.906 . . . . 0.0 111.444 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -121.96 109.28 14.41 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.967 1.307 . . . . 0.0 109.82 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -136.81 156.69 48.17 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 130.853 3.661 . . . . 0.0 105.723 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -117.7 114.94 24.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.576 1.08 . . . . 0.0 109.941 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -147.02 122.58 10.44 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.073 0.949 . . . . 0.0 109.556 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.7 tt -135.76 141.34 44.81 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.943 2.097 . . . . 0.0 107.578 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -151.61 171.31 17.82 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.682 1.193 . . . . 0.0 109.725 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.2 mt -123.98 130.52 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.7 t -125.88 151.92 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.511 1.525 . . . . 0.0 107.238 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -101.52 126.58 48.35 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.2 1.364 . . . . 0.0 108.321 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.8 mtp -64.91 -21.19 66.77 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.793 1.633 . . . . 0.0 112.323 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -54.56 38.96 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 119.052 0.842 . . . . 0.0 112.795 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.2 m -112.62 -2.51 14.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.755 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 59.5 34.61 22.57 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.468 1.907 . . . . 0.0 111.162 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -111.82 156.75 21.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.494 0.717 . . . . 0.0 110.464 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.53 142.45 56.54 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.087 . . . . 0.0 110.12 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.3 mt -120.7 175.72 5.88 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.142 1.777 . . . . 0.0 110.787 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.2 m -116.2 3.67 13.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.586 2.355 . . . . 0.0 111.019 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.1 t -160.16 160.79 33.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 p -97.68 121.18 39.28 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.346 1.459 . . . . 0.0 107.679 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.65 168.29 15.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.382 1.073 . . . . 0.0 110.607 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -50.74 -41.84 56.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -77.74 -1.68 32.47 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.769 0.713 . . . . 0.0 111.535 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.6 t -112.77 163.5 14.51 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.804 1.642 . . . . 0.0 110.831 -178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.32 134.26 17.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 129.315 3.046 . . . . 0.0 104.935 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.49 144.23 28.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -127.24 145.44 50.78 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 7.7 t -120.43 104.14 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 103.141 -2.911 . . . . 0.0 103.141 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -98.23 93.76 6.41 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -169.17 -167.48 0.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 49.89 67.98 0.82 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.836 1.654 . . . . 0.0 113.123 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.6 mt -71.47 144.42 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.353 1.461 . . . . 0.0 111.952 -178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -137.36 169.46 17.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.373 2.669 . . . . 0.0 110.102 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -121.48 154.65 36.32 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 126.414 1.886 . . . . 0.0 108.136 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.88 166.97 10.51 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 125.753 1.621 . . . . 0.0 109.978 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m -62.17 -27.56 69.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.415 0.286 . . . . 0.0 111.054 178.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -84.35 15.42 3.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.834 1.254 . . . . 0.0 110.471 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.9 mmmm 66.57 4.44 3.34 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.9 1.68 . . . . 0.0 111.056 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.01 164.65 26.38 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 178.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.0 mt -116.66 155.22 29.19 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 109.145 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.3 p -147.81 166.75 26.63 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.89 0.476 . . . . 0.0 110.039 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 50.5 ttm -130.86 141.95 50.35 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 126.077 1.751 . . . . 0.0 110.249 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.27 121.82 5.66 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 125.49 1.519 . . . . 0.0 110.483 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.2 mt -140.77 116.72 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 104.451 -2.426 . . . . 0.0 104.451 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 53.44 51.13 15.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.81 0.844 . . . . 0.0 110.628 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 62.4 -2.89 0.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.389 2.676 . . . . 0.0 115.769 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -101.98 138.35 39.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.368 1.867 . . . . 0.0 108.581 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -96.21 116.48 29.07 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -105.8 127.86 53.36 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.873 1.669 . . . . 0.0 109.33 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -63.41 150.73 42.89 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.994 0.918 . . . . 0.0 110.152 -179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -119.3 133.68 65.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 179.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -126.07 161.24 52.82 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.388 1.075 . . . . 0.0 110.03 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.45 153.83 65.46 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.864 2.376 . . . . 0.0 109.611 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.2 pm0 -56.56 -22.83 36.1 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.491 0.716 . . . . 0.0 110.819 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.6 m -57.17 -22.65 41.93 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.903 1.681 . . . . 0.0 111.19 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -76.31 1.1 17.09 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.731 1.212 . . . . 0.0 113.2 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.75 143.21 37.54 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 120.968 -1.083 . . . . 0.0 110.61 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.82 -42.44 1.9 Allowed Glycine 0 CA--C 1.522 0.508 0 C-N-CA 125.806 1.669 . . . . 0.0 110.737 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.65 -16.1 13.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.587 1.193 . . . . 0.0 111.771 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.51 143.47 41.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -135.15 169.61 17.18 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.465 1.106 . . . . 0.0 108.929 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.9 158.37 30.83 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.509 0.671 . . . . 0.0 109.602 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.19 164.12 13.83 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.489 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -113.24 135.78 53.45 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.362 1.065 . . . . 0.0 110.032 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.44 ' H ' HD11 ' A' ' 107' ' ' LEU . 0.7 OUTLIER -65.43 -10.64 35.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.971 1.709 . . . . 0.0 111.386 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -60.29 -25.36 65.68 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.696 1.599 . . . . 0.0 111.47 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -72.79 -0.23 12.77 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.397 -177.914 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.2 t80 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -141.0 -76.84 0.3 Allowed 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.4 p -73.19 123.04 22.87 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 120.085 1.311 . . . . 0.0 110.8 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 m -125.81 -19.47 4.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.585 1.554 . . . . 0.0 112.674 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -129.37 100.71 5.68 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.931 1.293 . . . . 0.0 108.919 -179.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -134.81 166.23 23.46 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.308 0.643 . . . . 0.0 111.536 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -59.61 155.35 15.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.293 1.437 . . . . 0.0 109.97 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.61 153.49 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -120.69 122.02 39.54 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 102.865 -3.013 . . . . 0.0 102.865 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -105.71 -178.03 3.53 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 120.822 1.646 . . . . 0.0 112.633 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -56.95 -33.95 67.53 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 129.153 2.981 . . . . 0.0 115.15 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 38.34 70.71 0.19 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 127.911 2.484 . . . . 0.0 114.28 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.0 7.97 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 113.6 -1.636 . . . . 0.0 111.981 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 179.26 6.57 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.021 0.928 . . . . 0.0 110.533 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.1 -169.62 0.64 Allowed 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.9 p -78.29 122.07 25.25 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 119.467 -2.021 . . . . 0.0 110.559 -174.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -166.27 147.03 6.4 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 130.479 3.512 . . . . 0.0 105.938 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 36.5 p90 -167.0 172.76 9.88 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 125.439 1.495 . . . . 0.0 107.917 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.2 mt -134.95 121.94 35.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 O-C-N 120.537 -1.352 . . . . 0.0 108.669 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -132.62 137.36 46.99 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.136 1.374 . . . . 0.0 107.83 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.45 34.13 17.55 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.149 1.38 . . . . 0.0 112.915 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 71.52 9.79 6.44 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.131 2.572 . . . . 0.0 113.277 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -111.04 139.17 46.63 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 134.04 38.71 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.5 m-85 -137.28 166.63 23.33 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 125.037 1.335 . . . . 0.0 110.354 -178.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -149.21 170.47 18.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.3 t -105.04 123.42 59.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 p -92.81 169.51 10.41 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.91 1.684 . . . . 0.0 110.503 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -79.2 -10.16 59.75 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.258 1.423 . . . . 0.0 111.978 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.74 100.15 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.826 0.851 . . . . 0.0 109.039 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -86.49 147.21 26.08 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.76 137.43 24.31 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.99 1.316 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.83 147.47 75.04 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.729 2.286 . . . . 0.0 109.326 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -55.78 -32.96 63.93 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.387 0.675 . . . . 0.0 112.728 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -64.9 -21.88 66.89 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.954 0.901 . . . . 0.0 112.075 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -90.98 -19.76 22.87 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.489 -0.757 . . . . 0.0 110.432 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.9 t -70.3 129.55 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -83.12 -61.58 1.82 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.74 0.816 . . . . 0.0 110.529 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.12 169.67 21.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.483 0.583 . . . . 0.0 110.763 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.7 p -64.77 153.03 41.11 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.026 0.93 . . . . 0.0 109.327 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.4 ' HE3' HD11 ' A' ' 82' ' ' LEU . 8.6 ttmm -124.66 -50.36 1.74 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.2 t -149.71 140.69 16.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -106.84 121.08 43.68 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.802 1.241 . . . . 0.0 108.073 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -150.3 159.03 44.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.423 3.489 . . . . 0.0 105.85 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.45 107.39 5.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -138.36 129.8 27.6 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.5 tt -137.84 138.41 39.1 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.17 169.3 18.14 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 125.284 1.433 . . . . 0.0 107.343 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 65.7 mt -124.43 131.21 73.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.443 ' C ' ' HG ' ' A' ' 66' ' ' SER . 5.3 t -122.25 127.62 75.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 124.865 1.266 . . . . 0.0 110.837 -178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -74.63 100.16 3.86 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 126.794 2.038 . . . . 0.0 107.482 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 73.1 mtp -55.22 -29.14 57.38 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.488 0.585 . . . . 0.0 112.157 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.64 84.67 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 125.03 1.332 . . . . 0.0 113.556 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -121.85 -4.63 9.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.955 1.252 . . . . 0.0 112.216 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 63.26 34.57 13.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.769 2.028 . . . . 0.0 110.291 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -119.83 157.14 29.28 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.095 0.958 . . . . 0.0 110.937 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.44 151.41 44.02 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.022 0.529 . . . . 0.0 111.648 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.4 mt -134.84 174.49 10.53 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.726 2.01 . . . . 0.0 109.07 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 21.0 p -117.16 -5.31 11.37 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.707 1.603 . . . . 0.0 112.705 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 m -144.88 129.97 18.5 Favored 'General case' 0 CA--C 1.521 -0.166 0 O-C-N 120.001 -1.687 . . . . 0.0 107.7 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.59 122.48 23.99 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -127.77 170.7 12.46 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.937 2.095 . . . . 0.0 108.349 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.407 ' HA ' ' HE2' ' A' ' 64' ' ' LYS . 9.5 mmpt? -58.63 -13.13 5.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -104.9 8.64 34.71 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.827 1.194 . . . . 0.0 109.325 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.443 ' HG ' ' C ' ' A' ' 51' ' ' VAL . 0.9 OUTLIER -127.21 162.03 27.12 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.441 1.097 . . . . 0.0 112.793 -177.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -132.31 160.04 42.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 126.363 1.865 . . . . 0.0 108.251 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 t -105.72 142.7 34.99 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -134.24 120.46 20.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.49 103.22 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -91.85 93.01 8.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.05 -169.22 2.12 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.12 67.4 0.84 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.848 2.059 . . . . 0.0 113.183 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.8 mt -73.59 146.81 9.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 O-C-N 121.057 -1.027 . . . . 0.0 111.064 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -142.75 169.47 17.51 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 126.674 1.989 . . . . 0.0 111.191 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -114.53 158.11 22.09 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 127.307 2.243 . . . . 0.0 106.103 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.58 167.41 14.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.597 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.5 t -62.99 -23.5 67.47 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 122.979 0.512 . . . . 0.0 111.481 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -86.7 6.63 30.33 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 120.805 -1.185 . . . . 0.0 109.47 179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm 68.89 1.18 3.02 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.976 2.51 . . . . 0.0 111.056 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.5 m -73.81 154.97 39.3 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.4 HD11 ' HE3' ' A' ' 42' ' ' LYS . 1.2 mm? -108.71 152.88 24.23 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.161 0.984 . . . . 0.0 110.341 -178.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.6 p -141.2 177.38 8.12 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.088 0.47 . . . . 0.0 111.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.9 ttm -136.69 138.23 40.83 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 126.234 1.814 . . . . 0.0 109.398 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.65 118.44 4.67 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 107.522 -2.231 . . . . 0.0 107.522 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -135.03 123.35 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 49.95 45.13 25.38 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 123.789 0.681 . . . . 0.0 109.878 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 63.15 18.99 11.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.528 1.931 . . . . 0.0 114.836 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -124.46 144.78 49.89 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.173 0.989 . . . . 0.0 109.844 178.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -94.15 115.99 28.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.735 0.698 . . . . 0.0 112.047 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.81 124.07 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.205 1.402 . . . . 0.0 109.764 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -62.28 147.94 46.49 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.54 1.136 . . . . 0.0 111.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -115.95 134.33 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 123.887 0.875 . . . . 0.0 109.238 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -127.6 158.46 69.91 Favored Pre-proline 0 C--O 1.235 0.313 0 C-N-CA 124.671 1.189 . . . . 0.0 109.983 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -75.39 154.3 40.6 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.718 2.279 . . . . 0.0 110.811 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.94 -6.48 12.62 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.957 -0.465 . . . . 0.0 111.811 178.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.3 p -72.86 -14.55 61.52 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.488 -1.382 . . . . 0.0 110.451 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.21 -4.92 58.02 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 142.51 34.08 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.01 0.924 . . . . 0.0 111.208 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.53 -15.24 19.99 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 126.107 1.813 . . . . 0.0 111.079 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.43 -12.68 0.8 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.473 1.509 . . . . 0.0 111.95 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.1 150.24 31.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -141.57 162.74 34.74 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.103 1.361 . . . . 0.0 108.368 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.31 167.02 1.47 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.572 0.701 . . . . 0.0 112.884 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.16 161.25 13.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.693 0.759 . . . . 0.0 112.559 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.0 mmm-85 -109.24 117.26 33.65 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -6.02 16.77 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.369 0.418 . . . . 0.0 111.795 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -59.52 -23.49 62.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 110.491 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -69.14 -12.09 61.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.728 0.811 . . . . 0.0 112.554 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.943 1.697 . . . . 0.0 107.746 -178.526 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 11.8 t80 . . . . . 0 N--CA 1.464 0.227 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -53.66 154.19 3.89 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.092 0.957 . . . . 0.0 111.107 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.5 m -138.46 98.54 3.61 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 m -132.42 147.97 52.39 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.442 1.497 . . . . 0.0 109.655 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.5 p80 -161.75 143.62 11.41 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.748 0.819 . . . . 0.0 110.23 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -144.27 173.05 12.1 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 127.283 2.233 . . . . 0.0 107.599 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.48 154.46 20.7 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.148 0.885 . . . . 0.0 110.376 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.2 t -95.06 133.17 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 125.627 1.571 . . . . 0.0 107.997 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -95.52 122.16 37.97 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -89.38 161.56 16.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -68.98 -33.78 74.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.827 1.651 . . . . 0.0 111.602 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 46.68 99.18 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 127.291 2.236 . . . . 0.0 114.802 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.74 20.75 53.12 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.039 -1.437 . . . . 0.0 112.395 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.91 179.53 6.12 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.75 1.62 . . . . 0.0 111.661 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -169.94 0.98 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.056 2.142 . . . . 0.0 107.361 177.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.0 p -80.63 120.4 24.52 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 124.586 2.136 . . . . 0.0 111.681 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -168.58 153.54 6.24 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 130.941 3.696 . . . . 0.0 106.108 177.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -168.52 173.79 7.26 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.0 mt -132.92 120.19 40.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -130.58 138.13 50.0 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t0 55.57 35.22 24.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.601 1.56 . . . . 0.0 112.071 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 65.1 15.65 10.12 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 127.345 2.258 . . . . 0.0 112.842 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -118.66 142.1 47.98 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.9 m -75.63 142.83 42.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -139.8 162.57 34.82 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.076 1.751 . . . . 0.0 109.585 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -148.86 166.81 27.42 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.675 1.19 . . . . 0.0 109.129 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.1 t -97.33 128.64 48.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 C-N-CA 123.04 0.536 . . . . 0.0 109.599 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -97.0 170.25 9.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.129 0.972 . . . . 0.0 111.112 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -77.82 -14.43 59.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.962 1.305 . . . . 0.0 111.982 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -69.01 101.21 1.35 Allowed 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 125.264 1.426 . . . . 0.0 110.614 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.14 141.6 28.53 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -118.14 143.98 33.95 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.482 1.113 . . . . 0.0 108.389 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.78 154.93 58.9 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.304 3.336 . . . . 0.0 113.383 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -58.22 -33.34 69.21 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.124 0.97 . . . . 0.0 111.9 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -62.52 -23.16 66.8 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.748 0.819 . . . . 0.0 111.539 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -90.49 -22.84 21.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.184 0.594 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.98 119.3 6.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -77.5 -59.96 2.56 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.082 0.953 . . . . 0.0 110.223 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.37 20.11 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.511 0.725 . . . . 0.0 110.533 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -65.38 165.33 12.04 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.031 0.92 . . . . 0.0 108.724 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.89 -53.37 1.42 Allowed 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 120.785 -1.197 . . . . 0.0 108.631 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 t -140.86 145.4 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm -124.81 92.95 3.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.665 1.186 . . . . 0.0 108.566 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -137.32 155.31 49.59 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 128.962 2.905 . . . . 0.0 106.851 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -120.96 130.49 53.86 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.856 0.862 . . . . 0.0 111.844 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.418 ' HE2' ' CD2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -148.81 126.85 11.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.403 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.4 tt -131.25 145.06 51.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.179 2.592 . . . . 0.0 110.256 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.418 ' CD2' ' HE2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -152.3 171.04 18.6 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.588 1.955 . . . . 0.0 109.506 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.4 mt -128.34 127.77 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.187 1.395 . . . . 0.0 108.096 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 t -122.68 148.8 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.43 1.492 . . . . 0.0 109.131 -179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -92.83 125.98 37.7 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.185 1.394 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 75.6 mtp -67.87 -26.23 65.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.869 1.213 . . . . 0.0 110.605 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -63.04 -41.55 99.52 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.4 m -121.99 -1.61 9.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.588 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 60.98 27.28 17.17 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.953 1.301 . . . . 0.0 109.835 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.47 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 9.3 mmpt? -103.45 154.03 19.88 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.391 1.076 . . . . 0.0 110.84 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.65 155.11 41.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 89.6 mt -131.32 175.12 9.4 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.164 1.386 . . . . 0.0 109.726 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -113.94 -4.81 13.21 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.315 1.446 . . . . 0.0 110.68 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.6 p -152.41 154.06 34.82 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 120.393 1.452 . . . . 0.0 108.98 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -84.59 124.44 31.44 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -129.07 165.58 20.94 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.662 1.585 . . . . 0.0 108.392 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -56.08 -43.72 78.29 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.429 -0.794 . . . . 0.0 112.359 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -74.61 5.74 4.53 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.6 t -113.58 166.25 11.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.324 1.45 . . . . 0.0 111.034 -179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.8 t -143.48 123.8 9.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 126.704 2.002 . . . . 0.0 106.358 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.8 t -80.51 144.32 32.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.39 147.26 52.55 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.78 103.5 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -99.05 91.76 5.17 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -166.97 0.96 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -176.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 55.79 67.09 1.06 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.676 0.391 . . . . 0.0 111.716 176.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mt -77.36 138.16 20.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.569 0.747 . . . . 0.0 110.632 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.7 m-85 -137.45 169.65 17.42 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 127.175 2.19 . . . . 0.0 109.808 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -118.17 156.76 28.17 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.125 1.77 . . . . 0.0 108.283 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.01 171.05 7.77 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 126.031 1.732 . . . . 0.0 112.375 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.2 p -57.07 -37.0 71.22 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 127.309 2.244 . . . . 0.0 112.176 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -87.72 16.13 6.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.532 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 69.38 -1.34 2.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 126.821 2.049 . . . . 0.0 111.134 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.67 164.89 20.55 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.86 0.755 . . . . 0.0 109.614 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.09 144.9 41.84 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.829 1.252 . . . . 0.0 109.415 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.37 168.25 20.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.869 0.868 . . . . 0.0 109.52 178.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 38.4 ttm -134.07 143.24 47.91 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.948 1.699 . . . . 0.0 109.749 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.85 124.43 6.85 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 125.217 1.389 . . . . 0.0 110.43 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 57.0 mt -143.13 120.92 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 53.8 44.81 29.03 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.293 1.044 . . . . 0.0 109.607 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.13 14.6 3.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.706 2.802 . . . . 0.0 114.327 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -116.86 147.48 42.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.722 1.609 . . . . 0.0 107.198 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -98.9 116.52 31.33 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.931 0.892 . . . . 0.0 112.527 -177.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -108.49 128.26 54.65 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.683 1.593 . . . . 0.0 109.781 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.423 ' HE2' HD23 ' A' ' 94' ' ' LEU . 7.3 ttpt -65.75 151.0 47.6 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.413 -0.804 . . . . 0.0 110.164 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.56 134.29 63.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.423 HD23 ' HE2' ' A' ' 92' ' ' LYS . 4.3 mm? -122.32 157.91 57.29 Favored Pre-proline 0 C--O 1.233 0.237 0 C-N-CA 124.023 0.929 . . . . 0.0 110.119 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.59 155.71 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.377 2.052 . . . . 0.0 110.346 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.64 -9.2 25.08 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.375 -0.828 . . . . 0.0 110.557 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 m -70.82 -8.1 50.1 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.279 2.232 . . . . 0.0 110.72 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . 0.257 0.0 OUTLIER -114.49 3.15 14.83 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -51.28 161.09 0.47 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.866 1.266 . . . . 0.0 111.784 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.33 -42.54 3.11 Favored Glycine 0 CA--C 1.522 0.519 0 O-C-N 120.926 -1.109 . . . . 0.0 111.351 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.96 53.18 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.124 1.462 . . . . 0.0 108.983 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.5 147.94 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 C-N-CA 126.443 1.897 . . . . 0.0 108.622 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -114.15 167.44 10.68 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.027 1.331 . . . . 0.0 108.508 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.88 166.08 20.24 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.851 0.834 . . . . 0.0 109.317 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.41 157.95 15.71 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -110.45 139.46 45.65 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.005 0.922 . . . . 0.0 113.27 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.2 -28.15 69.18 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.976 1.71 . . . . 0.0 110.105 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -53.22 -30.31 37.23 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.006 1.722 . . . . 0.0 113.792 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -70.08 -11.29 60.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.432 0.693 . . . . 0.0 109.661 -177.22 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 8.2 t80 . . . . . 0 N--CA 1.468 0.469 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -139.44 131.63 28.16 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.764 -1.21 . . . . 0.0 109.356 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.3 m -158.18 148.31 20.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 106.943 -1.502 . . . . 0.0 106.943 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 t -73.99 -175.76 2.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 1.0 . . . . 0.0 109.5 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -67.09 156.64 35.61 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.057 -1.027 . . . . 0.0 109.462 178.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -138.31 -177.37 4.81 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.563 1.945 . . . . 0.0 109.362 -178.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.74 111.37 15.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.088 1.355 . . . . 0.0 109.735 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.7 t -71.19 145.49 12.52 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 CA-C-N 119.193 0.906 . . . . 0.0 109.224 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 -103.14 97.35 7.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.5 145.0 41.72 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.24 -25.44 63.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.701 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 66.78 142.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.671 2.389 . . . . 0.0 112.901 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.99 28.03 15.89 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.249 0.928 . . . . 0.0 112.928 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -137.28 177.89 7.51 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 125.305 1.442 . . . . 0.0 110.931 -178.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -74.79 -168.9 0.79 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 127.173 2.189 . . . . 0.0 107.701 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.251 7.7 p -79.61 120.21 23.63 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 120.43 -1.419 . . . . 0.0 107.248 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -168.18 148.21 4.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 131.649 3.98 . . . . 0.0 104.712 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -172.68 165.57 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 mm -117.87 135.9 56.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 122.027 0.918 . . . . 0.0 108.642 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -149.09 142.74 25.48 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.221 -1.809 . . . . 0.0 108.962 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t0 51.85 33.61 11.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.871 1.268 . . . . 0.0 110.863 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 55.57 29.12 12.9 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 127.573 2.349 . . . . 0.0 112.463 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -124.6 144.01 50.4 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 m -81.88 114.43 20.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -117.76 165.7 13.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.722 2.009 . . . . 0.0 111.879 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.463 ' CE2' HG22 ' A' ' 29' ' ' THR . 21.9 p90 -150.33 173.89 13.48 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.175 1.39 . . . . 0.0 109.576 178.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.49 128.55 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.463 HG22 ' CE2' ' A' ' 27' ' ' PHE . 43.9 p -90.02 163.88 14.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.943 1.297 . . . . 0.0 113.584 -178.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -75.74 -16.78 60.09 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.221 1.809 . . . . 0.0 112.737 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -75.18 136.94 41.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.602 1.561 . . . . 0.0 106.893 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.402 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 42.3 tt0 -118.9 147.32 44.12 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.708 1.603 . . . . 0.0 111.095 -178.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.46 136.88 24.24 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.605 1.562 . . . . 0.0 107.432 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.02 156.87 26.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 124.615 3.543 . . . . 0.0 112.136 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -57.95 -28.47 64.35 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.811 0.844 . . . . 0.0 111.737 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -67.13 -14.42 62.89 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.07 -1.019 . . . . 0.0 112.119 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -104.08 -8.31 19.6 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.609 1.164 . . . . 0.0 110.889 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.65 132.38 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.703 1.601 . . . . 0.0 108.668 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -83.63 -56.09 3.92 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.572 1.149 . . . . 0.0 110.445 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.08 170.09 9.04 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.713 1.605 . . . . 0.0 109.412 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.8 p -68.97 174.03 4.86 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.7 tttp -138.92 -39.02 0.5 Allowed 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.179 -0.951 . . . . 0.0 112.407 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -149.34 117.55 0.93 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.714 0.806 . . . . 0.0 109.043 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 124.22 33.48 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 104.322 -2.473 . . . . 0.0 104.322 176.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.69 157.18 42.66 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 128.417 2.687 . . . . 0.0 105.312 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -140.59 109.7 6.14 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.413 1.085 . . . . 0.0 110.332 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -144.18 139.72 28.92 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -137.28 144.74 42.84 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 127.696 2.398 . . . . 0.0 108.256 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -154.47 169.55 23.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 61.9 mt -131.07 134.02 62.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 t -122.88 143.11 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.468 1.107 . . . . 0.0 108.282 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.08 123.86 28.74 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 106.388 -1.708 . . . . 0.0 106.388 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtp -68.24 -21.85 64.81 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 120.287 1.403 . . . . 0.0 114.018 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -74.27 -53.57 9.48 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.856 0.753 . . . . 0.0 110.364 -179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.8 m -91.92 -15.87 27.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.54 30.76 19.99 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 126.545 1.938 . . . . 0.0 111.798 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -115.59 161.09 19.13 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.633 1.173 . . . . 0.0 109.257 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.34 149.45 44.39 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.193 0.52 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 mt -129.19 173.05 10.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.33 1.852 . . . . 0.0 107.786 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 t -118.66 12.72 13.16 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.255 1.022 . . . . 0.0 111.512 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.5 p -159.07 157.75 31.7 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.827 1.194 . . . . 0.0 109.28 -179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 t -89.7 119.91 30.51 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.948 0.899 . . . . 0.0 110.098 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -130.72 160.12 35.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.314 1.045 . . . . 0.0 109.473 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -51.8 -20.72 2.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -104.32 5.71 34.73 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.807 1.639 . . . . 0.0 111.161 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 21.1 m -115.55 165.74 12.67 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 124.95 1.3 . . . . 0.0 111.203 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.8 t -140.57 144.5 27.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 124.515 1.126 . . . . 0.0 108.259 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.1 t -87.48 143.37 27.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.761 1.224 . . . . 0.0 108.89 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.0 mt -136.78 122.88 20.34 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.9 t -104.88 103.29 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 103.556 -2.757 . . . . 0.0 103.556 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.02 97.48 10.74 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.94 -172.92 2.2 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.22 68.96 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.939 1.696 . . . . 0.0 114.79 177.123 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.8 mt -71.03 141.14 17.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.73 1.612 . . . . 0.0 109.223 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -131.44 169.43 16.06 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.171 1.788 . . . . 0.0 109.341 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -114.85 152.79 31.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.207 1.403 . . . . 0.0 107.546 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.09 160.74 14.59 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.947 1.299 . . . . 0.0 109.824 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -65.07 -24.68 67.53 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.238 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -85.7 12.85 8.04 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 126.588 1.955 . . . . 0.0 110.662 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 69.75 -1.82 2.19 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.917 2.087 . . . . 0.0 110.524 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.0 m -70.97 168.69 16.45 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.4 148.8 45.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.909 0.884 . . . . 0.0 111.177 -178.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 21.1 p -141.94 172.06 13.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.151 0.98 . . . . 0.0 111.019 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.4 ttm -133.05 139.71 47.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 126.121 1.768 . . . . 0.0 109.365 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.59 124.3 6.64 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.5 mt -141.98 123.03 12.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 49.27 44.89 23.61 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.573 1.149 . . . . 0.0 110.871 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.6 t0 67.11 4.27 3.54 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.961 2.905 . . . . 0.0 116.142 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -111.81 145.89 38.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.903 1.281 . . . . 0.0 108.907 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -98.86 117.91 34.43 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 123.034 0.534 . . . . 0.0 111.656 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.402 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 84.6 m-85 -105.95 132.15 52.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.685 1.194 . . . . 0.0 107.808 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -72.1 158.54 35.75 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 118.596 -1.242 . . . . 0.0 110.336 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.63 133.56 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -127.04 163.51 41.18 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 125.991 1.716 . . . . 0.0 110.736 -177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.76 143.3 26.6 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.296 1.997 . . . . 0.0 107.859 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -12.64 20.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.3 m -65.77 -13.81 60.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -76.1 -1.24 25.11 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.362 1.065 . . . . 0.0 112.382 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -50.46 149.77 2.96 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.506 1.122 . . . . 0.0 109.273 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.62 -42.33 2.91 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.45 -39.56 13.28 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.568 0.747 . . . . 0.0 108.986 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -130.44 170.79 18.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 125.798 1.639 . . . . 0.0 109.6 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -145.25 166.34 25.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.469 2.308 . . . . 0.0 108.186 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.42 174.24 5.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.445 0.641 . . . . 0.0 110.792 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.292 0.4 OUTLIER -68.99 176.17 3.3 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.134 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ptp85 -129.92 141.47 50.78 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 125.157 1.383 . . . . 0.0 112.229 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.0 mp -71.63 -17.95 62.23 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.248 0.619 . . . . 0.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -57.8 -26.53 62.08 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.082 1.753 . . . . 0.0 113.484 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -76.63 -9.43 58.66 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.772 0.829 . . . . 0.0 110.446 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 121.574 0.702 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -161.27 158.27 26.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.474 1.91 . . . . 0.0 107.206 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.4 m 53.68 78.55 0.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.621 1.568 . . . . 0.0 109.811 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 84.4 p -137.48 97.0 3.36 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -70.35 114.56 8.6 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -142.12 179.16 7.06 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.267 1.827 . . . . 0.0 107.93 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 tptt -147.72 161.33 41.42 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.2 t -119.78 139.92 45.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 120.707 1.594 . . . . 0.0 108.798 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -107.18 118.41 36.65 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -84.66 175.42 9.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -80.84 -34.13 34.04 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 127.417 2.287 . . . . 0.0 110.459 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 54.13 127.64 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 128.465 2.706 . . . . 0.0 115.042 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.98 25.23 61.57 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.363 -0.836 . . . . 0.0 112.577 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 m -140.49 -179.62 6.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 126.95 2.1 . . . . 0.0 110.785 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -73.69 -171.06 0.96 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.491 1.516 . . . . 0.0 109.005 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.7 p -80.53 120.76 24.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 119.511 -1.993 . . . . 0.0 111.626 -175.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -167.16 154.9 9.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.44 3.896 . . . . 0.0 105.294 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 49.0 p90 -170.11 173.49 5.88 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.693 1.588 . . . . 0.0 107.437 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.1 mt -131.58 119.01 41.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 O-C-N 120.529 -1.357 . . . . 0.0 107.496 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -129.38 137.8 51.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.28 34.12 22.13 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.796 1.239 . . . . 0.0 111.438 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.7 m120 62.98 14.99 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.452 2.701 . . . . 0.0 112.931 -178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -111.62 132.94 54.22 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.8 m -76.32 129.06 36.08 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.0 m-85 -132.84 164.1 27.63 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 126.603 1.961 . . . . 0.0 110.516 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -149.25 159.37 44.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 109.442 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 t -89.72 132.23 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.4 p -102.04 166.3 10.69 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.732 1.213 . . . . 0.0 110.091 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.1 -7.69 55.32 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.342 1.057 . . . . 0.0 112.122 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -71.28 114.22 9.12 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -101.99 144.11 31.01 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.07 140.01 23.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.863 2.065 . . . . 0.0 108.403 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.77 156.15 39.56 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 123.016 2.477 . . . . 0.0 109.89 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.53 -29.47 69.14 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.12 -19.5 65.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.074 0.55 . . . . 0.0 111.936 179.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -93.17 -13.57 28.24 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.592 0.757 . . . . 0.0 110.28 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 65.7 t -75.2 123.5 31.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.24 -61.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.44 163.99 38.79 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.253 -0.904 . . . . 0.0 112.351 -178.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 m -65.5 137.26 57.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.601 1.56 . . . . 0.0 107.152 178.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HE3' ' OE2' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -112.29 -53.87 2.67 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.883 -177.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.1 t -141.01 134.39 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 119.814 1.188 . . . . 0.0 112.547 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.3 mtpt -103.53 110.21 22.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.05 156.75 44.1 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.445 2.698 . . . . 0.0 106.493 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -128.31 113.18 15.3 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.844 0.857 . . . . 0.0 110.723 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.88 134.41 18.63 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.954 0.797 . . . . 0.0 110.468 178.263 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.457 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 9.0 tt -138.32 145.04 40.69 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.85 1.66 . . . . 0.0 108.283 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.75 170.39 18.32 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.099 1.36 . . . . 0.0 107.402 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.9 mt -129.48 132.21 66.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.3 t -126.72 139.74 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.649 1.18 . . . . 0.0 109.458 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -85.99 128.36 34.83 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.309 -0.87 . . . . 0.0 109.406 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 46.9 mtp -68.64 -19.44 64.42 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttm -77.16 -46.85 22.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.519 1.509 . . . . 0.0 111.952 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.0 p -105.2 -6.06 20.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 63.88 18.81 11.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.695 1.198 . . . . 0.0 110.378 -179.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -101.72 159.91 14.91 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.342 0.974 . . . . 0.0 111.739 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.2 145.76 46.03 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.415 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 mt -126.6 166.32 17.53 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.893 2.077 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.83 -33.55 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.612 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.5 m -130.02 150.01 51.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.461 1.104 . . . . 0.0 109.551 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.92 111.09 17.79 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.495 0.718 . . . . 0.0 110.506 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -101.8 168.69 9.28 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 177.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -58.11 -32.66 68.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -78.53 -3.05 41.73 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.071 0.948 . . . . 0.0 110.445 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.4 t -114.58 161.66 17.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.393 1.477 . . . . 0.0 113.219 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.3 t -133.88 146.46 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 126.125 1.77 . . . . 0.0 108.431 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.29 144.19 29.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.966 1.306 . . . . 0.0 109.554 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.7 mt -135.37 122.53 21.53 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.865 -1.147 . . . . 0.0 108.162 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.5 t -106.71 103.41 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -99.36 96.64 7.85 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.124 -1.806 . . . . 0.0 106.124 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.22 -168.91 0.78 Allowed 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 50.06 68.31 0.77 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.88 1.272 . . . . 0.0 112.912 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.74 145.33 11.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.638 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -135.87 169.01 18.26 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.926 2.09 . . . . 0.0 109.064 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.42 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 tt0 -119.16 149.66 41.35 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.482 1.513 . . . . 0.0 107.071 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.56 166.58 10.64 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.593 1.557 . . . . 0.0 110.255 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.2 p -61.2 -29.95 70.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.911 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -101.58 29.47 4.85 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.995 1.718 . . . . 0.0 112.885 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 65.76 -0.82 1.19 Allowed 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.631 1.972 . . . . 0.0 114.055 178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -67.15 158.89 30.12 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.0 mt -115.62 144.43 43.91 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -138.76 164.88 28.44 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.8 ttm -127.7 137.35 52.45 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.317 1.847 . . . . 0.0 109.524 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.44 117.94 4.52 Favored Glycine 0 CA--C 1.521 0.438 0 C-N-CA 124.71 1.148 . . . . 0.0 110.393 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.8 mt -134.83 118.79 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 125.505 1.522 . . . . 0.0 107.101 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 49.94 47.21 23.56 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.481 1.113 . . . . 0.0 109.754 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 65.18 9.38 5.53 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.165 2.186 . . . . 0.0 114.733 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -115.48 136.95 52.56 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.164 1.386 . . . . 0.0 108.737 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -92.64 117.35 29.88 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.97 -0.456 . . . . 0.0 111.156 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 132.17 52.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.135 -0.978 . . . . 0.0 108.778 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 147.54 51.66 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -115.62 132.62 64.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -124.32 157.38 64.86 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 124.824 1.25 . . . . 0.0 108.775 -178.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.9 154.39 67.24 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.659 2.239 . . . . 0.0 109.685 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -61.04 -15.19 29.51 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.808 0.337 . . . . 0.0 111.631 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.3 p -80.05 -7.73 59.01 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 112.242 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -87.5 -9.58 54.14 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.696 1.598 . . . . 0.0 112.14 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.51 161.83 0.93 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.728 1.211 . . . . 0.0 113.492 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.78 -42.59 2.65 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 107.941 -2.064 . . . . 0.0 107.941 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.18 -27.62 22.92 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.194 0.998 . . . . 0.0 109.396 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.6 p -132.6 166.64 28.69 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.554 1.542 . . . . 0.0 109.882 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -135.94 165.19 26.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.841 2.456 . . . . 0.0 107.363 178.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.98 178.93 0.58 Allowed 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.452 0.644 . . . . 0.0 111.083 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.9 170.23 13.1 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.822 -0.549 . . . . 0.0 109.721 179.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -126.02 142.18 51.63 Favored 'General case' 0 CA--C 1.52 -0.199 0 O-C-N 121.166 -0.959 . . . . 0.0 110.11 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.4 -17.24 62.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.766 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.68 -18.07 61.74 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -73.15 -13.93 61.27 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.679 0.672 . . . . 0.0 111.784 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 C--O 1.248 0.988 0 C-N-CA 126.369 1.867 . . . . 0.0 110.342 -177.543 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 . . . . . 0 N--CA 1.474 0.775 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 75.5 41.41 0.27 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.13 2.572 . . . . 0.0 115.064 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.16 137.4 41.31 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.5 m -151.39 121.38 7.13 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.156 1.383 . . . . 0.0 107.982 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -129.72 120.11 24.58 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.983 1.313 . . . . 0.0 109.061 -179.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -162.73 152.74 16.14 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.658 -1.276 . . . . 0.0 110.803 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -67.86 163.76 21.2 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.4 t -116.44 160.27 15.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.039 1.335 . . . . 0.0 108.608 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -128.46 107.69 9.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 102.821 -3.029 . . . . 0.0 102.821 178.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -82.36 166.63 19.29 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -33.98 76.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.158 0.89 . . . . 0.0 110.801 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 55.66 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.606 1.962 . . . . 0.0 113.424 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.51 7.3 51.71 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.819 1.199 . . . . 0.0 112.477 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 m -131.96 179.31 6.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.112 1.765 . . . . 0.0 110.031 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -73.4 -169.74 0.7 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.118 2.167 . . . . 0.0 107.778 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.0 p -80.71 120.31 24.44 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 120.068 -1.645 . . . . 0.0 111.708 -176.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -168.82 147.12 3.99 Favored 'General case' 0 CA--C 1.54 0.573 1 C-N-CA 133.622 4.769 . . . . 0.0 103.224 177.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.445 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 44.9 p90 -165.55 169.17 15.74 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 125.311 1.444 . . . . 0.0 107.83 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.5 mp -123.52 123.02 66.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 O-C-N 120.472 -1.393 . . . . 0.0 108.014 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -133.09 139.2 47.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t70 54.03 33.23 17.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.506 1.522 . . . . 0.0 112.626 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 65.27 24.02 12.19 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.33 1.452 . . . . 0.0 110.486 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -125.13 137.23 54.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.34 144.59 40.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.545 -2.021 . . . . 0.0 105.545 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.445 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.6 m-85 -147.99 167.45 24.88 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 127.032 2.133 . . . . 0.0 110.472 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -150.02 171.29 17.08 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.041 0.937 . . . . 0.0 108.761 177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.96 127.53 58.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -94.9 169.19 10.31 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.467 1.107 . . . . 0.0 110.472 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.24 -15.52 58.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.937 1.295 . . . . 0.0 112.817 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 111.96 6.38 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.333 0.653 . . . . 0.0 111.196 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -93.6 140.18 29.91 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.67 141.32 24.43 Favored Pre-proline 0 N--CA 1.466 0.358 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.65 151.47 41.45 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.7 1.6 . . . . 0.0 111.194 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -53.97 -29.06 41.3 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.737 1.615 . . . . 0.0 113.263 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -69.89 -29.09 66.2 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 123.289 0.636 . . . . 0.0 110.864 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.91 -15.57 44.03 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.797 0.839 . . . . 0.0 110.666 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.32 138.8 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.446 HD21 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -92.8 -61.57 1.56 Allowed 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.266 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.34 166.49 18.61 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.086 0.857 . . . . 0.0 112.245 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.7 m -63.69 138.76 58.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.599 1.16 . . . . 0.0 109.069 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -116.27 -36.34 4.07 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -148.76 142.8 18.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -117.83 102.34 9.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -135.67 157.81 45.94 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 130.419 3.488 . . . . 0.0 106.577 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -141.45 110.45 6.21 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.103 1.361 . . . . 0.0 107.608 179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -141.1 125.53 17.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 tt -125.34 144.39 50.52 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.555 1.542 . . . . 0.0 107.749 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -153.45 169.95 21.92 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 108.948 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 31.8 mt -124.29 138.41 53.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 125.613 1.565 . . . . 0.0 106.785 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.6 t -132.77 124.82 51.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.429 1.092 . . . . 0.0 109.977 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -62.19 121.65 13.62 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.664 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.3 mtp -68.2 -18.24 64.53 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 120.71 1.596 . . . . 0.0 112.546 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -84.18 -25.69 29.36 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -122.35 -13.43 8.06 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.273 0.629 . . . . 0.0 111.802 -178.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 63.65 21.27 12.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.605 1.562 . . . . 0.0 109.901 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -105.18 153.15 21.94 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.61 1.164 . . . . 0.0 110.783 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -67.34 148.22 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.958 0.903 . . . . 0.0 110.856 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.5 mt -136.04 177.28 7.96 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.004 1.722 . . . . 0.0 109.392 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.3 p -105.65 -30.36 9.53 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.144 1.377 . . . . 0.0 111.088 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -122.03 151.89 40.35 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.005 0.82 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -89.07 93.28 9.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.243 0.617 . . . . 0.0 109.551 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.69 164.39 18.63 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -57.33 -34.24 68.55 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -80.72 5.39 15.88 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.642 -0.661 . . . . 0.0 111.584 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.4 t -113.42 177.99 4.44 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.201 1.4 . . . . 0.0 111.634 -178.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 p -145.85 159.19 12.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 126.686 1.994 . . . . 0.0 107.419 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.23 143.14 42.46 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.0 mt -131.33 150.87 51.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 t -127.86 102.65 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -86.14 92.03 8.61 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.29 -173.02 3.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 47.3 67.63 0.77 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.874 1.67 . . . . 0.0 112.882 177.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mt -77.9 141.81 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 O-C-N 121.177 -0.952 . . . . 0.0 109.498 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -140.87 166.11 25.69 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.942 1.697 . . . . 0.0 110.039 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -110.9 158.04 19.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.918 2.087 . . . . 0.0 106.952 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.94 168.78 9.77 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.544 1.138 . . . . 0.0 112.27 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -58.06 -35.89 72.0 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.91 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -84.89 21.13 1.65 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.684 1.193 . . . . 0.0 111.785 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.8 mptt 59.1 19.68 7.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.306 1.443 . . . . 0.0 110.721 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.512 ' HB3' ' HE2' ' A' ' 92' ' ' LYS . 63.3 m -79.69 168.68 19.03 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mt -125.46 143.59 50.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.5 p -147.84 168.64 21.68 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.608 0.763 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.0 ttm -135.23 139.54 44.56 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.181 1.792 . . . . 0.0 109.733 -178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.1 6.98 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.9 mt -138.72 124.42 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 52.07 42.53 30.55 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.826 0.822 . . . . 0.0 109.004 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 60.44 20.86 10.52 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.834 2.054 . . . . 0.0 114.105 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 -122.07 137.66 54.73 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.712 1.605 . . . . 0.0 108.477 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -93.27 116.32 28.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -106.52 129.83 54.41 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.536 1.135 . . . . 0.0 110.754 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.512 ' HE2' ' HB3' ' A' ' 81' ' ' SER . 51.1 tttm -64.28 145.36 56.14 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.621 -0.674 . . . . 0.0 109.878 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.52 133.09 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -120.13 156.64 54.6 Favored Pre-proline 0 C--O 1.238 0.468 0 C-N-CA 124.128 0.971 . . . . 0.0 109.342 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.02 141.88 54.61 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 N-CA-C 106.726 -2.067 . . . . 0.0 106.726 179.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -22.1 37.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.673 -0.642 . . . . 0.0 111.668 -179.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 t -66.16 -13.17 59.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.129 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -3.16 43.56 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 120.563 1.529 . . . . 0.0 114.098 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -50.85 162.01 0.31 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.24 1.416 . . . . 0.0 113.794 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.84 -43.65 2.98 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 127.074 2.274 . . . . 0.0 110.969 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.89 -22.54 45.8 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -133.05 159.23 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 C-N-CA 130.78 3.632 . . . . 0.0 106.1 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -135.6 169.42 17.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 123.461 0.704 . . . . 0.0 109.953 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.84 160.29 17.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.71 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.2 158.6 8.72 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.937 0.875 . . . . 0.0 112.774 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 -109.94 119.24 38.7 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 124.744 1.217 . . . . 0.0 108.551 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -9.35 43.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.937 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.62 -22.12 66.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.452 1.101 . . . . 0.0 110.959 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -70.24 -9.04 54.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.646 1.178 . . . . 0.0 113.356 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 125.018 1.327 . . . . 0.0 110.178 -178.078 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.811 0.338 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.1 t -80.52 133.4 29.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -103.23 111.9 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -89.61 149.74 22.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -62.62 -34.97 78.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.845 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 65.27 138.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.89 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.69 25.47 9.17 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.479 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.29 -175.91 4.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.363 . . . . 0.0 110.847 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -165.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.434 HG21 HD23 ' A' ' 105' ' ' LEU . 22.2 p -75.67 116.75 16.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.142 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -171.54 153.46 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.679 ' HZ ' HD12 ' A' ' 93' ' ' ILE . 9.8 p90 -174.9 158.1 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.886 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 84.8 mt -120.27 127.97 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -131.18 130.68 43.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t0 63.74 35.64 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.838 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 63.89 30.4 14.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.872 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -134.28 133.87 41.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -64.97 144.16 57.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.876 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 95' ' ' PRO . 5.7 m-85 -154.33 157.22 38.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 29' ' ' THR . 35.1 p90 -149.24 163.5 37.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 86' ' ' ILE . 21.7 t -88.77 127.33 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.164 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.52 HG22 ' CE2' ' A' ' 27' ' ' PHE . 19.1 p -97.78 165.19 12.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.14 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -73.04 -17.41 61.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.853 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.72 126.61 28.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.857 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.433 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.4 tt0 -110.24 140.39 44.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.433 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -113.13 134.4 21.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.59 0.709 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 147.4 62.32 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.644 2.23 . . . . 0.0 112.388 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -54.89 -31.62 60.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.923 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -62.67 -21.95 66.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -93.41 -20.44 20.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -70.56 135.78 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.143 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.41 -57.34 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -171.67 178.33 3.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.0 p -55.76 161.22 2.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HE2' HD12 ' A' ' 82' ' ' LEU . 12.3 tttm -131.85 -51.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.913 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.5 t -150.57 141.97 16.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.079 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -106.66 114.45 28.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -148.68 156.89 43.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -125.65 107.97 11.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE3' HD23 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -142.2 126.0 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.869 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 tt -138.08 138.98 39.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.644 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -152.18 169.39 22.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.731 ' O ' HD13 ' A' ' 58' ' ' LEU . 21.4 mt -122.82 135.79 61.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.085 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.735 HG22 HD22 ' A' ' 58' ' ' LEU . 14.1 t -129.52 137.5 56.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.094 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.631 ' OD2' HD11 ' A' ' 59' ' ' LEU . 2.0 t70 -86.12 123.26 31.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.4 mtp -69.17 -9.95 55.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.06 -54.2 28.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.955 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -122.15 10.03 9.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 55.94 35.94 26.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -111.48 158.2 19.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.735 HD22 HG22 ' A' ' 51' ' ' VAL . 2.1 mm? -76.14 152.25 36.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.896 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.631 HD11 ' OD2' ' A' ' 52' ' ' ASP . 64.4 mt -129.84 -172.63 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.943 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -114.48 -16.13 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 p -134.78 176.85 8.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.2 t -107.57 108.55 19.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.8 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -107.8 173.43 6.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -67.87 -29.18 68.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-20 -91.48 13.25 18.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.484 ' OG ' HG22 ' A' ' 50' ' ' ILE . 28.4 t -130.98 158.32 40.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.6 t -133.58 135.76 55.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.5 t -77.96 140.45 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.114 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.738 HD11 HD23 ' A' ' 107' ' ' LEU . 11.4 mt -131.91 131.09 42.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.481 HG12 ' OD1' ' A' ' 72' ' ' ASN . 14.4 t -112.83 103.96 16.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.142 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.6 HD21 HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -94.67 96.58 9.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.481 ' OD1' HG12 ' A' ' 70' ' ' VAL . 9.2 p-10 -175.94 -168.9 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.868 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 68.01 0.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 83' ' ' CYS . 13.3 mt -81.24 141.24 15.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.75 168.83 18.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -106.49 163.56 12.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.59 168.01 11.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.099 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -68.26 -27.61 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -95.61 26.6 3.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.888 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt 64.22 15.52 9.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.8 m -82.59 146.46 29.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.834 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' ' 82' ' ' LEU . 0.4 OUTLIER -103.5 149.64 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.424 ' O ' HG23 ' A' ' 74' ' ' ILE . 20.7 p -151.14 162.72 40.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.4 ttm -126.14 150.06 48.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.822 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -87.29 128.24 8.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.507 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.429 ' CD1' HG11 ' A' ' 28' ' ' VAL . 39.7 mt -146.2 111.86 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.811 0.338 . . . . 0.0 111.115 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.17 47.52 11.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 63.7 16.25 9.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -127.44 124.15 37.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -85.72 117.54 24.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -109.14 130.7 55.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.34 48.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.905 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.679 HD12 ' HZ ' ' A' ' 19' ' ' PHE . 4.7 pt -118.24 133.5 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.105 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 93' ' ' ILE . 4.6 mm? -127.16 159.46 64.94 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.622 0.725 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 53.6 Cg_endo -69.76 148.87 65.99 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 0.0 112.361 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -59.93 -20.14 55.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 49.5 m -69.23 -17.28 63.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -0.43 41.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -51.17 165.97 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 96.93 -41.47 2.34 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.5 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.41 -21.31 11.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.865 0.364 . . . . 0.0 111.116 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.13 146.68 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.163 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -129.45 166.33 19.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.947 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.48 168.02 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.095 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.612 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -68.52 164.89 20.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.612 ' N ' HD12 ' A' ' 105' ' ' LEU . 21.4 mtt85 -111.93 139.41 47.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.738 HD23 HD11 ' A' ' 69' ' ' LEU . 0.5 OUTLIER -71.65 -14.83 62.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.921 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -62.22 -17.06 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -78.78 -2.95 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' PHE . . . . . 0.997 ' O ' ' C ' ' A' ' 110' ' ' PHE . 22.5 m-85 . . . . . 1 C--O 2.0 40.583 1 CA-C-O 161.141 19.543 . . . . 0.0 110.877 179.99 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 tttt . . . . . 0 C--O 1.24 0.579 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 t -129.61 140.15 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 105.785 -1.932 . . . . 0.0 105.785 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -103.3 118.26 36.36 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.22 146.08 24.59 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -62.35 -34.87 77.51 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 64.28 133.59 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.702 2.001 . . . . 0.0 111.846 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.51 19.59 58.05 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.073 -1.017 . . . . 0.0 112.1 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.11 178.07 7.35 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.855 2.062 . . . . 0.0 109.983 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -169.56 0.78 Allowed 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.372 2.269 . . . . 0.0 107.771 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.2 p -79.96 120.74 24.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.378 -1.451 . . . . 0.0 107.743 -176.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -167.66 138.85 2.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.399 3.08 . . . . 0.0 106.117 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 35.9 p90 -162.15 177.94 9.23 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 123.561 0.744 . . . . 0.0 109.749 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 mt -137.93 122.92 23.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 C-N-CA 123.624 0.77 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 71.6 t80 -131.65 142.94 49.97 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.44 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 23.4 t70 56.32 34.31 23.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.809 1.244 . . . . 0.0 108.852 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 m120 62.35 12.05 4.98 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.254 2.222 . . . . 0.0 112.289 -178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.36 146.47 39.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 119.223 0.92 . . . . 0.0 109.235 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.1 m -75.38 133.48 41.18 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.302 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.6 m-85 -141.84 162.09 36.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.611 1.565 . . . . 0.0 109.123 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -148.56 161.73 41.08 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 121.031 -1.043 . . . . 0.0 108.619 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.79 130.76 40.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -100.19 169.83 8.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.128 0.971 . . . . 0.0 111.385 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.76 -14.63 61.15 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 126.935 2.094 . . . . 0.0 111.797 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -69.91 124.36 23.83 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 124.801 1.24 . . . . 0.0 109.693 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.32 144.74 40.02 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.421 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -123.74 138.7 30.85 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.384 1.474 . . . . 0.0 107.807 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.33 153.51 50.72 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.392 2.061 . . . . 0.0 112.646 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -50.39 -33.84 22.1 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 126.298 1.839 . . . . 0.0 114.45 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -67.82 -27.56 66.83 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.344 0.658 . . . . 0.0 111.625 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -82.45 -24.76 34.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -67.13 119.51 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -74.21 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.58 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.62 172.37 15.48 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.06 0.544 . . . . 0.0 111.2 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.1 t -60.74 157.86 13.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.411 1.484 . . . . 0.0 108.722 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.544 ' HE2' ' CD1' ' A' ' 82' ' ' LEU . 3.7 tttp -133.43 -51.22 0.87 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 117.498 -1.239 . . . . 0.0 111.299 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -144.28 112.05 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.258 0.936 . . . . 0.0 111.408 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -84.41 92.62 8.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.41 156.65 38.5 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 130.019 3.328 . . . . 0.0 105.981 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -135.93 121.63 19.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.714 1.605 . . . . 0.0 110.145 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.482 ' CE ' HD23 ' A' ' 49' ' ' LEU . 3.7 tmtm? -147.45 132.77 18.5 Favored 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tt -134.45 143.23 47.41 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 126.924 2.09 . . . . 0.0 106.249 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.482 HD23 ' CE ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -157.61 167.56 29.79 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.747 1.619 . . . . 0.0 107.695 178.113 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.5 mt -126.62 127.42 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.0 t -112.48 139.85 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.069 1.347 . . . . 0.0 109.584 -179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -87.01 120.86 28.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.153 1.381 . . . . 0.0 108.507 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.6 mtp -64.72 -21.07 66.67 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -77.01 -53.49 7.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 120.967 1.712 . . . . 0.0 111.937 -179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.5 m -96.9 -6.51 35.58 Favored 'General case' 0 CA--C 1.523 -0.072 0 CA-C-O 118.097 -0.954 . . . . 0.0 113.394 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 65.15 21.9 12.2 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -101.22 157.43 16.78 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 124.823 1.249 . . . . 0.0 111.088 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.82 152.83 33.26 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.409 ' CD1' HD22 ' A' ' 63' ' ' ASN . 69.0 mt -127.21 169.09 13.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.128 0.971 . . . . 0.0 109.814 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.2 p -109.99 11.56 23.96 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 126.988 2.115 . . . . 0.0 108.991 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.3 p -155.0 169.23 24.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.045 1.338 . . . . 0.0 111.714 -179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.8 t -101.62 110.84 22.91 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.409 HD22 ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -117.64 157.2 26.85 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.573 0.749 . . . . 0.0 109.206 178.937 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -32.25 69.94 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.628 1.558 . . . . 0.0 113.704 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -85.02 15.43 4.07 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.353 1.061 . . . . 0.0 109.896 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 p -120.88 162.85 19.12 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.676 1.19 . . . . 0.0 110.55 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.5 t -137.77 130.63 41.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.3 t -80.25 134.09 36.06 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 106.039 -1.838 . . . . 0.0 106.039 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.3 125.51 43.63 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 t -104.69 103.01 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 102.879 -3.008 . . . . 0.0 102.879 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -96.34 91.86 6.05 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -168.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -175.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 48.07 67.17 0.88 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.825 1.25 . . . . 0.0 111.598 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -72.02 144.9 12.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.932 1.293 . . . . 0.0 111.697 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -138.25 169.25 18.12 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.295 2.238 . . . . 0.0 110.403 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -117.15 162.71 17.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.123 2.169 . . . . 0.0 108.139 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.15 175.41 6.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.396 1.878 . . . . 0.0 111.358 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -53.27 -48.04 68.63 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.03 1.732 . . . . 0.0 111.754 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -85.48 18.86 2.56 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.083 -1.01 . . . . 0.0 111.936 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.11 8.91 5.98 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.534 1.933 . . . . 0.0 109.723 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -64.52 157.03 27.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.544 ' CD1' ' HE2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -116.17 155.28 28.54 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.334 -0.854 . . . . 0.0 111.361 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.9 p -151.54 168.89 23.51 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.6 ttm -135.98 143.65 44.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.724 1.609 . . . . 0.0 109.737 -178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.73 125.37 7.03 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 109.796 -1.321 . . . . 0.0 109.796 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mt -143.38 121.73 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 50.84 35.72 12.92 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.574 0.75 . . . . 0.0 111.084 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 74.63 12.51 3.75 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 126.17 1.788 . . . . 0.0 114.31 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -120.04 135.64 54.86 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.639 1.175 . . . . 0.0 109.006 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -88.86 115.83 26.7 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.476 0.711 . . . . 0.0 110.591 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -109.18 131.54 54.97 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.517 1.127 . . . . 0.0 111.247 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.421 ' HB2' HD13 ' A' ' 33' ' ' ILE . 10.6 ttpt -65.77 148.74 51.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.977 0.911 . . . . 0.0 110.31 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.414 HD11 ' HB3' ' A' ' 82' ' ' LEU . 1.3 pt -117.65 133.04 65.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -121.61 159.72 49.45 Favored Pre-proline 0 N--CA 1.467 0.405 0 C-N-CA 125.575 1.55 . . . . 0.0 109.21 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -71.98 151.36 56.13 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.07 1.847 . . . . 0.0 109.022 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.01 -5.68 5.01 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 p -80.16 -23.68 40.9 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.133 1.373 . . . . 0.0 111.181 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -72.31 -0.26 11.8 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.305 1.842 . . . . 0.0 114.539 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.1 mmtt -51.85 157.09 1.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.976 1.311 . . . . 0.0 111.272 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.1 -26.37 17.41 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.465 1.031 . . . . 0.0 111.483 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.03 -12.44 11.97 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.15 1.38 . . . . 0.0 110.149 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.8 p -150.26 150.27 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 C-N-CA 124.743 1.217 . . . . 0.0 108.127 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -129.82 173.0 11.08 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.895 2.478 . . . . 0.0 105.336 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 166.35 5.38 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.867 0.841 . . . . 0.0 111.043 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -61.58 162.48 8.25 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.012 0.925 . . . . 0.0 110.162 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.572 ' N ' HD12 ' A' ' 105' ' ' LEU . 86.2 mtt180 -111.5 138.82 47.52 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.445 0.698 . . . . 0.0 112.169 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.437 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.1 OUTLIER -70.61 -16.4 62.83 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.172 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -67.61 -3.82 10.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.637 1.175 . . . . 0.0 112.855 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -90.73 4.2 52.21 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 120.858 -1.152 . . . . 0.0 110.251 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 126.437 1.895 . . . . 0.0 107.994 -178.803 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 t -107.32 136.98 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.7 119.12 38.46 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 106.147 -1.798 . . . . 0.0 106.147 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -93.54 172.21 8.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.871 1.268 . . . . 0.0 110.125 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -65.02 -25.4 67.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 128.39 2.676 . . . . 0.0 114.695 178.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 45.12 92.96 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.919 2.087 . . . . 0.0 114.264 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 31.55 50.52 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 113.325 -1.761 . . . . 0.0 113.18 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -136.01 -178.96 5.38 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 127.392 2.277 . . . . 0.0 110.434 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.99 -170.99 0.8 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.873 1.269 . . . . 0.0 108.404 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -79.13 120.44 23.66 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.783 -1.823 . . . . 0.0 110.274 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -168.99 145.47 3.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.014 2.926 . . . . 0.0 107.421 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.475 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 45.4 p90 -165.15 166.42 19.03 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mp -123.16 121.87 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 120.886 -1.134 . . . . 0.0 108.715 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -131.82 140.31 49.11 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 55.23 36.69 27.56 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.29 1.036 . . . . 0.0 110.72 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 m120 59.49 18.91 7.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.886 1.674 . . . . 0.0 112.753 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.95 140.01 50.7 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 126.273 1.829 . . . . 0.0 106.148 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 m -80.0 140.51 36.56 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.5 m-85 -140.83 162.83 34.5 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.479 1.912 . . . . 0.0 110.72 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CD1' ' HE2' ' A' ' 99' ' ' LYS . 47.6 p90 -149.46 159.78 44.01 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.9 1.28 . . . . 0.0 109.64 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.5 t -89.06 133.47 31.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -99.67 169.95 8.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.206 1.003 . . . . 0.0 111.454 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -71.95 -21.01 61.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.64 2.776 . . . . 0.0 112.751 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 126.45 30.75 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.336 1.454 . . . . 0.0 112.711 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -99.31 147.68 24.94 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.82 2.048 . . . . 0.0 109.418 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.411 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -114.3 127.41 26.85 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.26 148.1 79.62 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 121.57 1.513 . . . . 0.0 110.666 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.74 -27.22 49.45 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -72.02 -19.79 61.8 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.441 0.696 . . . . 0.0 111.94 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -90.55 -21.66 21.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.72 -0.612 . . . . 0.0 110.102 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 82.5 t -59.49 137.26 22.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 124.905 1.282 . . . . 0.0 107.736 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.3 t-20 -91.12 -61.66 1.61 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 118.538 -0.744 . . . . 0.0 109.16 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -161.29 167.56 25.67 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.049 0.84 . . . . 0.0 112.057 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 36.9 m -69.4 133.79 48.22 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.769 1.228 . . . . 0.0 108.741 178.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -57.02 2.09 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 117.697 -1.145 . . . . 0.0 111.902 -178.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.1 t -141.0 121.99 13.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -84.98 117.6 24.06 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 105.025 -2.213 . . . . 0.0 105.025 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.19 159.74 43.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 128.584 2.754 . . . . 0.0 109.541 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -141.33 121.4 13.74 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.112 -0.992 . . . . 0.0 108.908 177.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 48' ' ' LEU . 2.1 tmtm? -148.14 137.44 22.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.463 ' N ' ' HD3' ' A' ' 47' ' ' LYS . 8.3 tt -134.93 143.29 46.82 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.775 2.03 . . . . 0.0 108.211 177.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -155.69 170.0 23.04 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.439 1.496 . . . . 0.0 109.539 177.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 mt -129.46 129.76 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.3 t -128.36 134.04 65.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.473 1.109 . . . . 0.0 111.04 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -71.13 117.52 12.75 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 128.12 2.568 . . . . 0.0 108.06 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.6 mtp -67.83 -23.27 65.15 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.833 1.197 . . . . 0.0 113.314 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -69.61 -53.37 19.15 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.972 0.805 . . . . 0.0 110.21 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.1 m -106.78 -2.93 20.98 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 117.07 2.248 . . . . 0.0 117.07 -177.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 59.05 35.08 23.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.823 1.249 . . . . 0.0 112.128 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -116.73 148.37 41.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.482 1.113 . . . . 0.0 109.289 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.7 155.05 40.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 79.1 mt -131.3 170.59 14.4 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 109.807 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.4 p -92.36 -27.48 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.669 1.187 . . . . 0.0 112.714 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.0 m -135.83 163.33 30.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.06 1.344 . . . . 0.0 110.392 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -88.11 109.74 20.11 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.453 1.501 . . . . 0.0 110.166 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -119.09 157.95 26.83 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -55.81 -18.75 9.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -92.04 7.8 40.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 119.538 1.063 . . . . 0.0 110.356 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 t -133.83 166.89 21.61 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.473 1.909 . . . . 0.0 111.041 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -142.2 156.21 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.99 1.716 . . . . 0.0 107.878 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.2 t -105.69 143.9 33.19 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.27 1.428 . . . . 0.0 108.577 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.44 133.69 44.17 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.0 t -104.52 102.3 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 103.846 -2.65 . . . . 0.0 103.846 178.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -82.83 95.62 7.97 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -163.55 -173.42 3.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 47.27 68.77 0.59 Allowed 'General case' 0 C--N 1.342 0.248 0 C-N-CA 127.694 2.398 . . . . 0.0 112.705 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.5 mt -72.45 140.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 44.5 m-85 -134.64 170.27 16.05 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 127.284 2.233 . . . . 0.0 109.218 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.65 152.62 34.82 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 126.077 1.751 . . . . 0.0 108.079 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.8 165.57 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.965 1.706 . . . . 0.0 109.216 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.2 t -61.56 -24.77 66.88 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.896 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -81.88 7.93 11.63 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.577 2.351 . . . . 0.0 110.042 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt 68.84 -0.8 2.24 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.32 2.248 . . . . 0.0 109.794 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.1 t -75.16 168.57 19.73 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.434 ' CB ' HD11 ' A' ' 93' ' ' ILE . 2.0 mm? -114.81 156.18 25.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.401 1.081 . . . . 0.0 111.853 -178.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.3 p -145.8 166.48 25.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.842 0.857 . . . . 0.0 110.384 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 52.9 ttm -132.52 140.15 48.2 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.889 1.676 . . . . 0.0 109.285 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.15 110.23 3.31 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 124.884 1.23 . . . . 0.0 112.838 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.8 mt -130.55 124.37 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 49.59 53.67 12.33 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.436 2.294 . . . . 0.0 109.233 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 59.95 11.8 2.79 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.861 2.065 . . . . 0.0 114.825 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -119.43 132.89 55.9 Favored 'General case' 0 CA--C 1.514 -0.405 0 O-C-N 120.95 -1.094 . . . . 0.0 109.715 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -86.17 115.82 23.98 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -108.44 132.2 54.02 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.179 0.992 . . . . 0.0 110.56 -178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.411 ' HB2' HD13 ' A' ' 33' ' ' ILE . 16.9 ttpt -65.26 151.17 46.85 Favored 'General case' 0 C--O 1.238 0.449 0 O-C-N 122.053 -0.405 . . . . 0.0 111.023 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.475 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -117.25 133.22 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.26 157.7 55.11 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 125.274 1.43 . . . . 0.0 109.208 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.27 153.78 56.43 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.031 3.154 . . . . 0.0 110.846 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.57 -17.93 57.08 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.111 0.564 . . . . 0.0 111.544 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.9 m -77.0 -20.73 55.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.057 -0.497 . . . . 0.0 111.993 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.77 -0.16 41.85 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.901 0.773 . . . . 0.0 110.737 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.442 ' HE2' ' CD1' ' A' ' 27' ' ' PHE . 61.7 mmtt -59.98 150.75 28.07 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 102.09 -31.9 8.16 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 109.136 -1.585 . . . . 0.0 109.136 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.2 -19.36 14.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.93 1.692 . . . . 0.0 110.167 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.79 154.16 10.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 127.407 2.283 . . . . 0.0 106.854 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -131.34 170.87 14.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.718 1.607 . . . . 0.0 108.622 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.43 165.2 14.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.9 168.4 13.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -113.25 140.23 48.14 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 125.159 1.384 . . . . 0.0 109.454 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.406 ' H ' HD12 ' A' ' 107' ' ' LEU . 2.6 mp -71.47 -13.2 61.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.108 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -56.93 -26.72 59.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.949 0.9 . . . . 0.0 111.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -64.38 -19.65 65.62 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.197 1.399 . . . . 0.0 112.821 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.375 1.87 . . . . 0.0 111.646 -177.012 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt . . . . . 0 N--CA 1.463 0.21 0 CA-C-O 121.512 0.672 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -90.55 118.7 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.462 ' HD2' HD13 ' A' ' 20' ' ' ILE . 10.8 ttm180 -84.59 100.65 11.56 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.42 138.94 40.68 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -64.95 -34.67 78.96 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 115.351 1.611 . . . . 0.0 115.351 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 57.86 139.86 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.899 2.079 . . . . 0.0 114.751 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.36 15.87 52.97 Favored Glycine 0 CA--C 1.534 1.273 0 O-C-N 121.156 -0.965 . . . . 0.0 111.965 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.11 177.33 7.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 127.644 2.378 . . . . 0.0 108.914 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -167.31 0.49 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 131.038 3.735 . . . . 0.0 109.24 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.285 24.2 p -78.76 119.07 21.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 123.771 1.748 . . . . 0.0 106.985 -176.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.13 139.75 2.87 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 130.974 3.71 . . . . 0.0 107.676 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -162.6 156.75 21.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 128.116 2.566 . . . . 0.0 107.08 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.462 HD13 ' HD2' ' A' ' 10' ' ' ARG . 2.2 mp -118.92 126.24 75.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 123.618 0.767 . . . . 0.0 108.971 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -131.5 138.66 49.06 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.291 1.036 . . . . 0.0 110.046 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.9 t70 54.05 34.16 19.24 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.343 1.857 . . . . 0.0 113.071 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 66.02 31.48 9.03 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 0.0 110.923 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -134.62 127.66 31.62 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 126.168 1.787 . . . . 0.0 106.641 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.6 m -76.16 132.11 39.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.95 172.59 9.27 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 127.951 2.5 . . . . 0.0 111.797 -177.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.316 25.9 p90 -153.19 144.79 23.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 129.486 3.114 . . . . 0.0 113.63 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' ILE . 47.3 t -82.52 133.84 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.6 p -103.57 167.88 9.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.694 1.198 . . . . 0.0 110.107 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -72.14 -12.0 61.0 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.895 1.678 . . . . 0.0 113.201 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 111.44 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.911 1.284 . . . . 0.0 113.238 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.409 ' C ' HD12 ' A' ' 33' ' ' ILE . 57.7 tt0 -89.92 146.71 24.2 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.424 1.49 . . . . 0.0 109.29 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.409 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.68 140.04 24.84 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.697 1.599 . . . . 0.0 107.929 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.81 150.35 61.69 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.817 . . . . 0.0 110.672 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -61.37 -19.42 61.84 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.51 -21.44 60.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.375 0.67 . . . . 0.0 110.588 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -87.69 -20.04 26.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.836 0.454 . . . . 0.0 111.554 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.0 t -61.3 130.45 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -89.87 -57.96 2.68 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.505 1.122 . . . . 0.0 110.5 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -164.05 172.33 13.96 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.079 0.952 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.8 p -68.16 162.7 24.25 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -137.28 -45.07 0.56 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.33 122.81 2.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 118.598 0.635 . . . . 0.0 112.069 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -99.9 112.13 24.41 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -150.05 156.45 41.69 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 129.302 3.041 . . . . 0.0 104.893 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -131.8 119.36 21.15 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.46 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -148.12 135.12 20.21 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.46 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.1 tt -137.88 138.18 38.81 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 127.238 2.215 . . . . 0.0 109.147 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -144.42 169.65 17.53 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.991 0.916 . . . . 0.0 110.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.59 128.29 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.042 1.337 . . . . 0.0 107.957 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.67 134.68 65.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 124.799 1.24 . . . . 0.0 108.839 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -76.92 124.24 27.47 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 54.4 mtp -68.79 -29.76 68.18 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 120.255 -1.528 . . . . 0.0 112.887 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -79.48 -53.33 6.99 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.526 0.73 . . . . 0.0 110.784 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -81.48 -17.03 50.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.95 -1.024 . . . . 0.0 111.76 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 59.87 37.44 21.69 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.28 0.945 . . . . 0.0 109.664 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -129.42 161.38 30.5 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.411 1.084 . . . . 0.0 112.392 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.47 147.08 40.13 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.119 0.887 . . . . 0.0 110.061 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.8 mt -131.54 170.49 14.65 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.801 1.24 . . . . 0.0 112.112 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.83 -44.8 8.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.1 161.12 22.3 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.217 1.007 . . . . 0.0 112.665 -177.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.8 p -80.71 96.59 6.96 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -77.23 168.21 20.44 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 105.585 -2.006 . . . . 0.0 105.585 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -69.95 -23.32 63.17 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -80.93 2.95 24.52 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 m -119.28 161.0 21.15 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.653 1.181 . . . . 0.0 112.581 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 55.9 t -136.66 154.95 32.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 126.501 1.92 . . . . 0.0 106.144 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.65 143.47 37.67 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.525 HD21 HD23 ' A' ' 107' ' ' LEU . 2.0 mm? -125.54 145.52 50.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -116.46 103.06 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -101.81 94.54 5.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -164.97 -173.35 2.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.176 -177.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 51.35 68.09 0.85 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.058 0.943 . . . . 0.0 113.241 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mt -74.68 143.86 12.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 124.903 1.281 . . . . 0.0 109.155 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -136.64 170.22 16.42 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.381 2.272 . . . . 0.0 109.868 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -116.97 157.77 25.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 126.316 1.846 . . . . 0.0 107.699 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.29 165.47 15.43 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.38 1.472 . . . . 0.0 111.463 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.5 t -56.08 -36.32 67.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.587 1.555 . . . . 0.0 111.326 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -87.99 17.93 4.59 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.667 0.787 . . . . 0.0 110.969 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt 67.61 3.25 3.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.372 1.869 . . . . 0.0 111.914 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.0 m -68.63 154.87 41.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.2 mt -114.63 147.58 39.35 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.4 p -142.52 169.08 18.25 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.734 0.414 . . . . 0.0 110.987 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 tpp -128.79 140.15 51.85 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.085 2.154 . . . . 0.0 108.464 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -88.27 115.63 4.43 Favored Glycine 0 N--CA 1.462 0.391 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 45.5 mt -132.09 119.98 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.5 m120 50.5 47.09 24.65 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 122.1 0.953 . . . . 0.0 111.139 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 62.7 9.94 3.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 128.69 2.796 . . . . 0.0 113.672 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -112.08 125.3 53.95 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.613 1.565 . . . . 0.0 107.989 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -86.14 116.03 24.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.43 132.11 54.1 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.573 1.149 . . . . 0.0 109.402 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -63.61 155.46 29.62 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.465 0.706 . . . . 0.0 112.632 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -124.62 132.69 70.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 178.435 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.29 160.05 59.57 Favored Pre-proline 0 N--CA 1.474 0.767 0 C-N-CA 126.026 1.73 . . . . 0.0 110.248 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.52 152.32 78.62 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 109.835 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -60.64 -14.82 22.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.56 -0.257 . . . . 0.0 111.666 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.92 -13.64 62.55 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.283 -0.886 . . . . 0.0 110.953 177.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -2.75 40.53 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.829 1.195 . . . . 0.0 111.277 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp -52.47 152.16 3.72 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 120.846 -1.159 . . . . 0.0 110.954 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.68 -42.34 3.04 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -95.65 -14.0 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.211 1.506 . . . . 0.0 110.9 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 20.0 t -143.13 155.06 16.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 C-N-CA 126.818 2.047 . . . . 0.0 106.996 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -133.75 162.38 32.12 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.208 1.003 . . . . 0.0 109.08 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.33 159.7 26.19 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 165.09 13.56 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -125.27 140.34 52.92 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.711 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.0 OUTLIER -65.04 -12.85 55.13 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 126.369 1.868 . . . . 0.0 112.692 179.671 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.31 -16.68 48.31 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.417 1.008 . . . . 0.0 112.15 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -81.49 -5.02 57.53 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 110.981 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.873 2.069 . . . . 0.0 107.045 -179.705 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.37 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.2 t -124.45 144.16 35.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 124.414 1.086 . . . . 0.0 110.26 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -112.56 138.13 49.8 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -113.41 152.17 30.4 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.69 -25.84 68.12 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.659 0.784 . . . . 0.0 111.622 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.8 137.99 0.03 OUTLIER 'General case' 0 C--O 1.236 0.383 0 C-N-CA 129.327 3.051 . . . . 0.0 112.022 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.95 38.04 30.38 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.881 1.229 . . . . 0.0 111.545 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -139.82 179.04 6.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.347 1.859 . . . . 0.0 112.307 -176.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -74.67 -169.19 0.82 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.532 2.733 . . . . 0.0 107.91 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.254 22.8 p -80.16 120.46 24.32 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 119.385 -2.072 . . . . 0.0 109.363 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -168.83 143.41 3.18 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 129.604 3.161 . . . . 0.0 106.548 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 41.3 p90 -164.44 173.17 12.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 119.285 0.948 . . . . 0.0 109.139 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -130.67 123.27 54.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 O-C-N 121.538 -0.726 . . . . 0.0 109.512 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -137.26 145.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 104.632 -2.358 . . . . 0.0 104.632 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.1 t0 53.47 35.33 20.38 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 122.419 1.104 . . . . 0.0 111.399 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 57.59 22.83 8.61 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.347 1.859 . . . . 0.0 113.126 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -123.41 150.77 43.36 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.618 1.567 . . . . 0.0 109.305 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.8 m -79.29 123.05 27.08 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 8.4 m-85 -127.5 161.35 28.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.423 1.489 . . . . 0.0 109.087 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' CE2' HG22 ' A' ' 29' ' ' THR . 31.3 p90 -149.17 167.38 26.12 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.004 -1.06 . . . . 0.0 108.408 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -97.45 127.58 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 ' CE2' ' A' ' 27' ' ' PHE . 30.3 p -94.99 167.49 11.36 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.752 1.221 . . . . 0.0 111.689 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -75.15 -13.0 60.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.978 1.711 . . . . 0.0 111.988 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' HG13 ' A' ' 102' ' ' VAL . 1.7 mptp? -69.59 102.77 1.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.645 1.578 . . . . 0.0 109.6 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -89.93 145.64 24.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.47 139.93 22.55 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.599 1.959 . . . . 0.0 108.823 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.59 148.61 20.59 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.26 2.64 . . . . 0.0 109.893 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -55.27 -31.97 61.99 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.26 -19.39 64.51 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.58 0.752 . . . . 0.0 112.629 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -101.84 -9.76 20.48 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.523 0.729 . . . . 0.0 111.064 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.6 t -74.87 124.2 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -73.66 -59.57 2.65 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.375 1.07 . . . . 0.0 110.799 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.7 p30 -171.19 169.07 6.58 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 126.172 1.789 . . . . 0.0 109.63 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 57.5 p -62.48 169.61 2.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.301 1.84 . . . . 0.0 112.913 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -140.51 -47.71 0.43 Allowed 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 116.746 -1.597 . . . . 0.0 114.364 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 t -153.06 130.02 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 121.248 1.84 . . . . 0.0 111.416 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -99.29 106.13 18.22 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.296 1.038 . . . . 0.0 111.042 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -128.87 158.04 39.87 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 129.65 3.18 . . . . 0.0 106.166 178.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.03 109.83 6.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.487 1.04 . . . . 0.0 109.761 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.36 139.0 22.85 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.985 0.811 . . . . 0.0 109.898 178.037 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.506 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.2 tt -133.53 141.76 47.89 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.465 1.506 . . . . 0.0 108.53 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.584 HD11 HD21 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -148.92 171.16 16.78 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.183 1.393 . . . . 0.0 110.74 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.4 mt -127.3 142.57 43.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.76 1.224 . . . . 0.0 110.725 -178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -137.48 128.83 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.711 1.204 . . . . 0.0 111.712 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.48 ' HB2' HD21 ' A' ' 59' ' ' LEU . 9.4 t0 -73.62 111.48 8.8 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.801 1.64 . . . . 0.0 108.041 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 63.0 mtp -56.99 -25.22 57.96 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.355 1.434 . . . . 0.0 113.494 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? -60.09 -53.52 56.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.947 0.499 . . . . 0.0 111.05 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.5 m -106.12 -6.54 18.53 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 59.57 30.84 20.51 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.803 2.041 . . . . 0.0 109.878 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.94 154.01 24.71 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 124.923 1.289 . . . . 0.0 112.34 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.11 150.1 49.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.22 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.48 HD21 ' HB2' ' A' ' 52' ' ' ASP . 54.3 mt -127.45 174.31 9.11 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 124.417 1.087 . . . . 0.0 110.781 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -108.96 0.45 20.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.802 2.041 . . . . 0.0 113.028 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.1 p -163.01 162.98 26.22 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.543 1.137 . . . . 0.0 108.413 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.7 m -91.72 117.43 29.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.486 1.914 . . . . 0.0 112.818 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -124.35 157.22 35.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.97 1.708 . . . . 0.0 109.317 177.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -56.28 -18.03 9.39 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.66 4.18 52.04 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.364 0.666 . . . . 0.0 111.072 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.5 t -120.32 169.53 10.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.995 2.118 . . . . 0.0 107.92 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 92.5 t -143.47 145.38 22.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 t -95.46 142.18 28.13 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 106.479 -1.675 . . . . 0.0 106.479 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.2 mt -123.6 151.73 42.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.7 t -128.49 104.33 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 105.332 -2.099 . . . . 0.0 105.332 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 49' ' ' LEU . 2.1 mm? -97.94 95.12 7.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.601 1.092 . . . . 0.0 109.837 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -167.49 -167.75 0.93 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 56.0 67.9 0.94 Allowed 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.418 1.087 . . . . 0.0 113.701 175.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.3 mt -77.87 139.99 17.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 121.195 -0.941 . . . . 0.0 109.038 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.82 168.41 19.88 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.834 2.054 . . . . 0.0 109.229 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -115.23 151.22 34.87 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 126.363 1.865 . . . . 0.0 107.204 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.12 159.99 16.43 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.527 1.531 . . . . 0.0 109.837 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -59.54 -33.24 71.15 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.986 0.914 . . . . 0.0 110.779 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -83.05 17.0 2.1 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.877 1.271 . . . . 0.0 110.405 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp 68.65 2.09 3.29 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.84 2.056 . . . . 0.0 111.142 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 44.3 m -70.01 160.98 30.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.95 146.09 41.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.542 1.137 . . . . 0.0 108.145 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.2 p -142.48 167.14 22.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.542 -0.724 . . . . 0.0 110.609 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 36.0 ttm -134.13 137.47 44.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.552 1.941 . . . . 0.0 109.029 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.6 123.38 6.03 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 127.336 2.398 . . . . 0.0 111.087 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.7 mt -138.98 117.32 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 50.67 43.69 27.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.901 0.881 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 73.94 -1.28 3.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.123 2.569 . . . . 0.0 115.357 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -105.45 134.76 48.04 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.968 1.307 . . . . 0.0 108.6 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -89.89 117.09 28.45 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.12 0.568 . . . . 0.0 109.819 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -109.02 130.24 55.47 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.289 1.436 . . . . 0.0 110.742 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -62.89 147.76 49.29 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.308 0.643 . . . . 0.0 110.387 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -115.95 133.46 62.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.21 161.05 56.56 Favored Pre-proline 0 C--O 1.236 0.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.952 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -74.95 144.29 30.26 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 122.696 2.264 . . . . 0.0 109.05 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -58.11 -18.18 23.31 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.78 -11.1 59.99 Favored 'General case' 0 N--CA 1.445 -0.71 0 O-C-N 121.006 -1.059 . . . . 0.0 112.571 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.5 1.66 28.5 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.34 1.427 . . . . 0.0 112.426 178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -46.11 144.42 1.94 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 126.606 1.962 . . . . 0.0 112.279 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.43 -43.11 1.94 Allowed Glycine 0 CA--C 1.518 0.251 0 C-N-CA 127.172 2.32 . . . . 0.0 110.662 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.06 -18.17 22.1 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 117.936 0.868 . . . . 0.0 110.457 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.4 HG13 ' HE2' ' A' ' 31' ' ' LYS . 2.0 t -138.62 158.1 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 125.832 1.653 . . . . 0.0 107.713 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -141.98 168.63 19.28 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 127.938 2.495 . . . . 0.0 106.629 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.63 -179.66 1.46 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.744 0.783 . . . . 0.0 111.038 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.95 173.25 10.23 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -123.39 141.86 51.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.719 1.208 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.429 ' H ' HD12 ' A' ' 107' ' ' LEU . 1.1 mp -69.97 -8.84 52.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.403 0.681 . . . . 0.0 111.787 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.24 -22.37 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.964 1.706 . . . . 0.0 110.942 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.97 -5.57 49.16 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.833 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 124.843 1.257 . . . . 0.0 111.556 -177.979 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 14.6 ttmm . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.417 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 24.1 t -126.71 126.12 68.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -91.67 135.72 33.67 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -106.18 165.35 11.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.49 -33.54 48.11 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 53.19 98.08 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.996 1.718 . . . . 0.0 113.386 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 9.25 37.46 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 125.466 1.508 . . . . 0.0 112.955 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.9 m -131.6 178.68 6.55 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 127.39 2.276 . . . . 0.0 109.469 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.4 -167.9 0.48 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 130.733 3.613 . . . . 0.0 107.833 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.4 p -78.87 121.13 24.44 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 124.317 2.008 . . . . 0.0 109.642 -176.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -167.0 143.84 4.58 Favored 'General case' 0 N--CA 1.448 -0.558 1 C-N-CA 132.299 4.24 . . . . 0.0 104.6 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.426 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 29.4 p90 -165.2 171.26 13.9 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 125.044 1.338 . . . . 0.0 107.447 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -132.72 123.53 49.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 O-C-N 121.558 -0.714 . . . . 0.0 109.533 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -128.07 136.64 51.49 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 125.515 1.526 . . . . 0.0 107.019 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.4 t70 52.45 34.95 16.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.272 1.429 . . . . 0.0 110.355 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 64.64 12.73 7.78 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.795 2.038 . . . . 0.0 112.593 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -106.38 138.08 43.2 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 126.216 1.807 . . . . 0.0 108.299 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -68.72 136.64 53.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.3 m-85 -144.9 159.27 43.17 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.976 0.911 . . . . 0.0 109.275 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -149.36 164.26 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.394 -0.816 . . . . 0.0 109.174 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 t -97.63 132.31 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.27 175.57 5.43 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.379 0.609 . . . . 0.0 109.729 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -77.06 -11.09 59.76 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.38 1.072 . . . . 0.0 113.208 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.19 110.97 5.48 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.211 1.004 . . . . 0.0 108.871 178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -98.88 143.42 29.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.439 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -118.75 136.19 24.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.67 159.44 52.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.931 2.421 . . . . 0.0 112.905 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -61.83 -27.75 68.99 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -71.77 -22.67 61.56 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.946 0.794 . . . . 0.0 110.093 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -84.47 -24.7 29.35 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -64.81 147.07 12.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.42 HD21 ' HA ' ' A' ' 78' ' ' SER . 25.3 t-20 -112.08 -60.97 1.78 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.602 1.161 . . . . 0.0 110.937 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -153.93 168.01 27.82 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.391 0.676 . . . . 0.0 112.486 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 p -69.87 147.57 50.13 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 126.12 1.768 . . . . 0.0 109.196 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -119.25 -52.6 2.28 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 117.791 -1.1 . . . . 0.0 111.404 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 t -149.11 118.59 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 119.787 1.176 . . . . 0.0 112.598 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -86.03 101.45 12.94 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 177.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.49 158.23 34.99 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 128.834 2.854 . . . . 0.0 107.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -141.12 108.16 5.45 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 120.21 1.368 . . . . 0.0 111.984 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.757 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -148.13 138.58 22.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.325 -0.859 . . . . 0.0 110.432 178.423 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -130.76 145.08 51.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 127.467 2.307 . . . . 0.0 108.15 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.757 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -150.24 171.34 17.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.394 1.877 . . . . 0.0 109.03 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.0 mt -128.22 131.93 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 124.433 1.093 . . . . 0.0 108.104 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.59 130.21 74.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.296 1.038 . . . . 0.0 111.01 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.63 122.61 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 127.244 2.217 . . . . 0.0 110.109 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.0 mmm -69.25 -21.8 63.88 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -83.07 -53.26 5.94 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.495 1.118 . . . . 0.0 110.991 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.3 m -92.4 -11.01 36.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.105 -178.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 60.89 23.43 13.48 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 120.073 1.306 . . . . 0.0 110.766 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 mtpp -110.98 162.7 14.58 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.944 1.298 . . . . 0.0 111.371 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.621 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -74.98 146.57 41.57 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.29 0.636 . . . . 0.0 110.88 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.5 mt -135.22 174.98 10.01 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.87 1.668 . . . . 0.0 109.761 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.9 m -115.09 -8.65 12.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.607 1.163 . . . . 0.0 110.455 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.6 m -116.92 127.11 53.92 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.569 1.148 . . . . 0.0 113.086 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.1 t -80.13 99.23 7.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -121.41 166.84 13.52 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.369 0.668 . . . . 0.0 109.984 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -56.5 -36.78 69.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -87.73 18.53 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.065 0.546 . . . . 0.0 110.401 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.8 t -138.37 154.46 48.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 126.173 1.789 . . . . 0.0 108.678 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.64 139.87 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.052 0.941 . . . . 0.0 109.194 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.71 144.37 26.04 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.938 0.895 . . . . 0.0 109.543 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -136.15 150.47 49.07 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.013 1.325 . . . . 0.0 107.519 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 t -125.37 103.35 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.29 95.26 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -160.59 -174.82 4.65 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 44.81 68.95 0.48 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.73 2.012 . . . . 0.0 114.616 178.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.6 mt -68.9 145.36 13.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.679 1.192 . . . . 0.0 110.107 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -140.12 169.69 17.22 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 128.134 2.574 . . . . 0.0 110.414 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -115.78 163.68 15.48 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 127.781 2.432 . . . . 0.0 108.672 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -120.86 168.64 11.25 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.799 2.04 . . . . 0.0 109.994 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.42 ' HA ' HD21 ' A' ' 39' ' ' ASN . 9.2 t -57.3 -36.93 71.69 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.97 18.78 2.84 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.874 1.27 . . . . 0.0 111.403 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt 66.14 9.86 6.61 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.065 1.346 . . . . 0.0 112.261 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 t -73.92 137.92 43.95 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -100.18 150.46 22.49 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 122.974 0.51 . . . . 0.0 109.808 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.1 p -145.68 171.11 15.2 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.802 0.441 . . . . 0.0 112.117 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.9 ttm -137.18 142.17 42.17 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.1 1.76 . . . . 0.0 110.644 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.81 129.55 9.14 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 124.772 1.177 . . . . 0.0 110.824 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.9 mt -147.6 126.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 50.69 39.99 23.03 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.765 0.826 . . . . 0.0 110.396 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 63.54 15.55 8.93 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.975 2.11 . . . . 0.0 114.755 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -118.22 140.34 49.95 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 125.495 1.518 . . . . 0.0 107.388 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -91.33 116.15 28.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.903 -0.498 . . . . 0.0 110.81 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.28 127.25 53.38 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.975 1.31 . . . . 0.0 109.769 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.572 ' HE3' HD21 ' A' ' 94' ' ' LEU . 15.9 tttp -60.98 154.65 21.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.184 0.993 . . . . 0.0 110.216 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -120.24 132.66 69.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.572 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.1 mm? -120.42 155.47 56.36 Favored Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 124.486 1.114 . . . . 0.0 110.286 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.35 147.87 60.04 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.706 2.271 . . . . 0.0 107.864 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.11 -18.43 47.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.136 0.426 . . . . 0.0 111.919 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.6 t -67.51 -21.61 65.48 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 121.301 -0.875 . . . . 0.0 109.964 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -79.66 -3.11 45.79 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.119 0.968 . . . . 0.0 113.392 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -52.62 155.87 2.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.313 1.054 . . . . 0.0 109.571 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.85 -42.51 2.65 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.24 -32.47 24.44 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 p -137.7 162.37 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 C-N-CA 125.957 1.703 . . . . 0.0 108.955 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -136.31 170.61 15.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.922 2.489 . . . . 0.0 107.529 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.11 166.24 2.95 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.797 0.808 . . . . 0.0 110.699 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.614 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -65.15 171.9 3.39 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.177 0.591 . . . . 0.0 111.558 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.614 ' N ' HD12 ' A' ' 105' ' ' LEU . 61.9 mtm180 -127.29 136.29 51.76 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.722 0.809 . . . . 0.0 111.162 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.8 OUTLIER -67.32 -21.32 65.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 124.342 1.057 . . . . 0.0 112.2 -179.405 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -60.05 -10.85 4.72 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -81.9 -0.43 43.73 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.867 0.758 . . . . 0.0 109.81 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.245 0.839 0 C-N-CA 127.579 2.352 . . . . 0.0 107.914 -179.454 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.286 0 CA-C-O 120.598 0.237 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.8 t -132.96 130.62 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.7 ttm-85 -102.6 115.83 31.36 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -86.81 166.77 14.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -75.19 -33.04 61.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.933 0.788 . . . . 0.0 112.104 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 60.41 117.73 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.297 1.839 . . . . 0.0 114.295 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.63 18.96 78.54 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -137.94 178.04 7.42 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.938 1.695 . . . . 0.0 111.184 -178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -74.18 -168.38 0.63 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 128.707 2.803 . . . . 0.0 108.937 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.4 p -79.12 120.16 23.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.436 2.065 . . . . 0.0 107.849 -176.154 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -168.64 145.76 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 130.353 3.461 . . . . 0.0 105.941 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 39.4 p90 -165.21 174.91 9.75 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.215 2.206 . . . . 0.0 106.771 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 73.2 mt -135.44 128.28 47.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -137.09 140.63 42.09 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.2 t70 51.83 39.19 25.16 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.9 1.68 . . . . 0.0 112.489 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.61 16.78 10.66 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.629 1.572 . . . . 0.0 112.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -120.2 141.87 49.52 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.872 1.269 . . . . 0.0 110.08 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.9 m -72.33 127.42 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.691 1.597 . . . . 0.0 108.706 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -140.39 160.03 40.89 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.565 0.746 . . . . 0.0 112.34 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -148.8 162.57 39.53 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 121.21 -0.931 . . . . 0.0 111.189 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.2 t -92.23 127.55 44.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 124.097 0.959 . . . . 0.0 109.894 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.8 p -98.97 171.13 8.24 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.817 1.247 . . . . 0.0 109.863 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -81.17 -10.9 59.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.998 1.719 . . . . 0.0 112.598 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.29 111.5 5.94 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.552 1.941 . . . . 0.0 109.692 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.8 tt0 -95.96 146.36 24.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.309 1.444 . . . . 0.0 111.864 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.99 131.77 24.01 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.748 2.419 . . . . 0.0 107.253 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.95 156.28 47.82 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.591 2.86 . . . . 0.0 112.484 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -58.26 -26.6 63.12 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.085 0.954 . . . . 0.0 113.5 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.41 -26.21 63.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.317 0.508 . . . . 0.0 110.665 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -82.82 -25.33 32.79 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.56 118.2 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.014 0.925 . . . . 0.0 108.598 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -77.77 -61.04 2.12 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.049 0.94 . . . . 0.0 109.776 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -159.75 173.63 15.73 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.86 0.864 . . . . 0.0 109.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.423 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 70.0 m -62.91 171.36 2.2 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.024 1.33 . . . . 0.0 110.933 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -145.79 -45.03 0.21 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 120.559 -1.338 . . . . 0.0 113.746 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.2 t -152.44 132.88 4.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-N 118.983 0.811 . . . . 0.0 109.693 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -109.52 109.01 19.69 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.094 1.358 . . . . 0.0 107.782 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -139.39 157.41 45.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 127.894 2.478 . . . . 0.0 107.274 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -125.27 107.48 10.76 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.469 ' HE2' HD23 ' A' ' 49' ' ' LEU . 12.8 tptm -145.59 122.72 11.46 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.835 0.743 . . . . 0.0 109.332 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.4 tt -129.73 143.36 50.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 128.548 2.739 . . . . 0.0 106.575 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.469 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -152.23 170.54 19.77 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 126.047 1.739 . . . . 0.0 107.245 178.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.434 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.5 mt -129.22 132.02 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.1 t -121.98 136.16 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.047 1.339 . . . . 0.0 108.755 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -78.85 119.04 21.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 126.001 1.72 . . . . 0.0 109.301 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.9 mtp -68.44 -19.53 64.58 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 121.789 2.086 . . . . 0.0 111.531 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -38.27 69.08 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 117.914 -1.041 . . . . 0.0 113.638 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.3 p -121.98 -9.06 8.79 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 60.31 41.19 16.74 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 125.969 1.707 . . . . 0.0 111.024 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -122.47 158.26 30.15 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.902 1.281 . . . . 0.0 109.491 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.434 HD13 ' O ' ' A' ' 50' ' ' ILE . 4.3 mm? -71.02 146.95 49.07 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.02 0.528 . . . . 0.0 111.734 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.6 mt -132.64 158.17 42.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.704 1.602 . . . . 0.0 110.3 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -86.75 -21.84 26.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.524 0.73 . . . . 0.0 110.726 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -135.95 146.79 47.65 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.462 1.505 . . . . 0.0 111.246 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.64 98.85 11.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 127.595 2.358 . . . . 0.0 112.03 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -97.08 171.76 8.27 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.8 -0.563 . . . . 0.0 110.155 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -53.61 -21.89 7.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.697 2.399 . . . . 0.0 117.462 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -105.73 1.17 26.86 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.578 1.951 . . . . 0.0 110.675 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.7 t -114.69 161.83 17.62 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.974 1.71 . . . . 0.0 110.63 -177.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.2 t -138.55 126.46 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 124.612 1.165 . . . . 0.0 109.284 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.9 t -77.31 143.09 39.07 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.9 mt -130.21 145.41 51.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.38 103.69 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.26 93.03 6.66 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -166.31 -162.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 44.17 67.28 0.7 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.699 1.999 . . . . 0.0 111.482 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 mt -75.14 142.64 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.427 1.091 . . . . 0.0 110.105 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 73.6 m-85 -141.87 158.6 43.59 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -103.03 165.5 10.99 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.718 1.207 . . . . 0.0 110.104 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.24 169.99 12.31 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.733 0.813 . . . . 0.0 112.736 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -58.78 -41.1 85.88 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.245 1.418 . . . . 0.0 109.814 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.03 13.24 5.22 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.579 1.951 . . . . 0.0 109.797 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.46 10.98 5.23 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.85 2.06 . . . . 0.0 110.922 -177.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.2 m -65.41 149.58 49.76 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -111.32 140.23 46.06 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.13 175.2 9.82 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.818 0.847 . . . . 0.0 112.086 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.8 ttm -134.83 142.14 46.57 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.9 2.08 . . . . 0.0 108.967 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.65 125.78 8.09 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.953 -1.659 . . . . 0.0 108.953 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.2 mt -142.6 121.53 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 48.35 54.94 9.59 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.254 1.421 . . . . 0.0 113.51 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 69.25 -2.84 1.71 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.88 1.672 . . . . 0.0 114.712 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -112.78 156.7 22.41 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 125.129 1.372 . . . . 0.0 109.469 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.69 117.0 29.6 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.14 0.976 . . . . 0.0 109.396 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.76 133.64 52.91 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.269 1.428 . . . . 0.0 112.175 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HE3' HD21 ' A' ' 94' ' ' LEU . 13.2 ttpt -63.1 145.07 56.25 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.757 0.823 . . . . 0.0 110.877 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -110.36 132.63 58.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.482 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.4 mm? -126.46 156.32 73.07 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.19 161.8 42.18 Favored 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 122.247 1.965 . . . . 0.0 111.057 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -21.25 66.46 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.56 -6.04 37.77 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.024 1.33 . . . . 0.0 112.579 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.33 -3.94 36.05 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.374 0.988 . . . . 0.0 111.69 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 20.1 mmtm -54.47 156.96 3.06 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-N 119.596 1.089 . . . . 0.0 111.873 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 108.49 -42.81 1.85 Allowed Glycine 0 CA--C 1.521 0.464 0 N-CA-C 108.396 -1.882 . . . . 0.0 108.396 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.37 -42.25 8.99 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.1 159.96 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 125.617 1.567 . . . . 0.0 110.77 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -143.07 173.29 11.7 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.694 2.798 . . . . 0.0 107.0 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.6 164.88 4.18 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.655 1.182 . . . . 0.0 110.359 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 172.96 3.89 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -116.97 127.39 54.15 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 125.385 1.474 . . . . 0.0 108.655 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.518 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -64.93 -20.17 66.32 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.578 0.751 . . . . 0.0 111.121 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -55.04 -24.86 26.91 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.54 1.536 . . . . 0.0 111.782 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -68.86 -16.0 63.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.495 -0.753 . . . . 0.0 110.416 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 125.999 1.72 . . . . 0.0 109.789 -178.98 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt . . . . . 0 C--O 1.232 0.18 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.43 135.89 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.1 ttt-85 -107.91 98.52 8.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -82.24 148.92 28.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.55 -33.73 73.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 117.885 -1.055 . . . . 0.0 112.686 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 79.06 131.07 0.05 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 129.7 3.2 . . . . 0.0 114.281 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.41 34.49 54.64 Favored Glycine 0 CA--C 1.522 0.501 0 C-N-CA 126.088 1.804 . . . . 0.0 111.196 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.9 p -137.83 178.48 7.08 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 110.575 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.78 -170.08 0.65 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.891 2.076 . . . . 0.0 109.328 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.3 p -79.6 120.22 23.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 123.927 1.822 . . . . 0.0 108.535 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -167.44 149.95 5.98 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 130.976 3.71 . . . . 0.0 105.014 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 42.7 p90 -172.88 175.86 3.22 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.4 mt -134.56 130.94 53.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -130.61 138.15 49.97 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.6 t0 47.57 42.97 15.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.747 1.619 . . . . 0.0 113.832 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 61.0 22.51 12.75 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 0.0 112.877 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -122.9 128.64 50.6 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.222 1.809 . . . . 0.0 106.623 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 71.2 m -74.75 132.25 41.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -130.35 166.28 20.75 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 127.013 2.125 . . . . 0.0 110.348 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -148.54 166.35 28.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -99.63 126.93 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.2 p -93.26 171.18 9.08 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.896 0.878 . . . . 0.0 110.291 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -77.86 -15.67 58.87 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.463 1.505 . . . . 0.0 111.53 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.8 122.77 18.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.991 1.317 . . . . 0.0 110.618 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 32.6 tt0 -111.0 145.68 38.02 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.227 1.411 . . . . 0.0 110.394 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -115.64 141.23 27.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.651 1.18 . . . . 0.0 108.654 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.99 152.15 51.19 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.208 2.605 . . . . 0.0 110.352 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.55 -33.04 63.5 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -64.56 -20.8 66.46 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -90.97 -15.38 29.81 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.566 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.2 t -70.9 123.75 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.906 0.882 . . . . 0.0 108.623 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -75.67 -62.04 1.72 Allowed 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.87 173.01 14.27 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.135 0.88 . . . . 0.0 110.825 178.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.5 p -65.34 135.78 55.72 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 125.49 1.516 . . . . 0.0 110.206 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.98 -49.39 3.14 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 116.996 -1.478 . . . . 0.0 112.656 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.8 t -143.92 122.01 6.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 120.185 1.357 . . . . 0.0 112.052 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -83.05 114.31 21.2 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.11 158.84 44.58 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 127.828 2.451 . . . . 0.0 109.623 -178.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -143.44 119.75 10.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.011 0.924 . . . . 0.0 109.434 178.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' HE3' HD23 ' A' ' 49' ' ' LEU . 3.0 tmtm? -148.08 136.61 21.57 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -133.59 144.71 49.46 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.338 1.855 . . . . 0.0 109.072 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.438 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -156.3 169.67 24.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.016 1.327 . . . . 0.0 109.551 177.732 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.9 mt -126.43 136.0 62.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 125.492 1.517 . . . . 0.0 107.898 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.2 t -134.82 134.25 53.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 125.911 1.684 . . . . 0.0 109.991 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -72.13 116.81 12.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 127.917 2.487 . . . . 0.0 111.699 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.7 mtp -68.24 -18.28 64.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.128 0.876 . . . . 0.0 112.176 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -66.43 -53.78 31.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.818 1.19 . . . . 0.0 111.372 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.7 m -122.6 8.61 9.53 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 59.44 47.09 11.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.227 1.811 . . . . 0.0 112.939 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -116.64 147.17 42.17 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.368 1.067 . . . . 0.0 108.883 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mp -69.52 155.8 39.9 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.36 157.81 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.723 1.209 . . . . 0.0 110.465 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.9 p -88.1 -12.44 44.13 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.285 -1.34 . . . . 0.0 114.194 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 p -147.66 148.99 31.64 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 121.136 1.789 . . . . 0.0 112.31 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -69.77 116.97 10.77 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.862 1.265 . . . . 0.0 109.393 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -137.43 156.64 47.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.18 1.392 . . . . 0.0 109.806 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -54.44 -31.64 55.84 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -80.39 3.57 20.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.322 0.965 . . . . 0.0 111.311 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -124.47 177.01 6.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.934 1.694 . . . . 0.0 111.616 -177.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.0 t -142.46 150.28 18.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 127.959 2.503 . . . . 0.0 105.831 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.8 t -102.61 140.63 36.63 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.32 144.84 50.3 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 t -115.9 103.32 15.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.87 94.37 8.9 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.361 -1.462 . . . . 0.0 107.39 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -164.25 -173.76 3.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -177.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 46.45 69.46 0.48 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.335 1.854 . . . . 0.0 114.815 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.3 mt -70.01 143.87 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.53 169.39 17.87 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.775 2.03 . . . . 0.0 108.833 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -117.96 154.13 32.46 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.28 161.07 16.4 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.526 1.13 . . . . 0.0 110.009 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -65.78 -13.36 59.27 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.274 0.63 . . . . 0.0 111.421 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 2.89 56.41 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.224 1.41 . . . . 0.0 109.472 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm 79.6 -1.59 2.16 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 129.157 2.983 . . . . 0.0 112.11 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.5 m -77.35 162.38 27.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 120.55 1.523 . . . . 0.0 108.099 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.17 158.43 17.44 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.224 1.01 . . . . 0.0 109.639 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.3 p -149.32 172.79 14.32 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.037 0.835 . . . . 0.0 109.522 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.3 ttm -136.03 135.85 39.77 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.789 1.636 . . . . 0.0 108.449 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.26 109.88 3.12 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 74.9 mt -123.03 123.81 68.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.9 m120 51.7 37.91 21.41 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.794 1.237 . . . . 0.0 109.609 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 69.24 16.31 8.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.89 2.876 . . . . 0.0 114.554 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -117.17 132.75 56.58 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -86.5 115.92 24.3 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.569 -0.707 . . . . 0.0 110.252 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 76.4 m-85 -110.21 128.27 55.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.861 1.265 . . . . 0.0 111.295 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.94 144.63 52.76 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.037 0.935 . . . . 0.0 110.315 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.57 132.91 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.36 156.48 57.78 Favored Pre-proline 0 N--CA 1.467 0.384 0 C-N-CA 124.457 1.103 . . . . 0.0 108.658 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -75.12 156.41 42.47 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.23 1.953 . . . . 0.0 108.505 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -65.5 -11.18 41.03 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.464 -0.773 . . . . 0.0 110.958 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -21.93 63.81 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.166 -0.959 . . . . 0.0 109.503 177.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.9 -7.39 59.6 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.483 1.113 . . . . 0.0 111.823 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -56.07 149.33 15.84 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 107.87 -32.05 7.43 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -178.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.97 -8.97 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.416 1.486 . . . . 0.0 111.887 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -150.54 150.2 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 C-N-CA 126.404 1.882 . . . . 0.0 107.13 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -131.06 169.67 15.55 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.765 1.626 . . . . 0.0 107.994 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.65 163.4 11.44 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.126 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.35 167.65 10.16 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt85 -110.36 135.67 50.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 126.148 1.779 . . . . 0.0 110.753 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -68.77 -15.58 63.55 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -59.03 -23.02 61.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.186 1.794 . . . . 0.0 111.441 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.5 m-20 -73.57 -6.02 43.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 118.341 -0.837 . . . . 0.0 111.981 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.565 1.546 . . . . 0.0 111.755 -177.822 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 121.217 0.532 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.3 t -110.12 130.55 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -89.15 116.97 27.8 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -85.08 153.3 22.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -59.66 -34.34 72.71 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 128.109 2.564 . . . . 0.0 113.96 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 59.66 103.64 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 127.944 2.498 . . . . 0.0 113.704 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.409 ' HA2' ' CD2' ' A' ' 58' ' ' LEU . . . 69.93 31.84 69.84 Favored Glycine 0 CA--C 1.528 0.88 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.279 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -134.71 179.88 6.02 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.397 1.879 . . . . 0.0 112.659 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.53 -168.59 0.45 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.155 2.582 . . . . 0.0 107.502 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -78.46 120.37 23.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 116.993 -1.883 . . . . 0.0 108.295 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -168.06 146.68 4.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 128.949 2.899 . . . . 0.0 107.808 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -170.87 177.05 3.92 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.321 0.964 . . . . 0.0 109.429 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 44.1 mt -135.65 126.28 43.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 121.446 -0.784 . . . . 0.0 109.031 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -129.86 134.24 47.4 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 105.576 -2.009 . . . . 0.0 105.576 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.8 t0 53.15 38.09 26.64 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.255 1.022 . . . . 0.0 112.49 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 m120 62.57 16.02 8.43 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.482 2.313 . . . . 0.0 113.112 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -111.4 136.95 49.82 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.46 1.104 . . . . 0.0 108.796 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -71.55 122.24 20.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.449 1.5 . . . . 0.0 107.611 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -134.48 162.33 32.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.181 1.393 . . . . 0.0 109.957 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -149.27 171.89 15.76 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.397 1.079 . . . . 0.0 108.527 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 t -100.82 125.26 54.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.5 p -96.52 170.47 9.19 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.521 1.129 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -77.72 -9.44 59.0 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.185 1.794 . . . . 0.0 112.961 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -70.19 97.46 1.21 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.858 1.263 . . . . 0.0 108.523 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -89.14 145.1 25.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 123.655 0.782 . . . . 0.0 109.672 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.95 142.77 33.91 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 126.514 1.926 . . . . 0.0 112.399 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.79 146.82 30.35 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 123.836 3.024 . . . . 0.0 109.728 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -53.99 -31.52 51.2 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.741 1.216 . . . . 0.0 113.874 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.72 -29.06 69.53 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.317 -0.864 . . . . 0.0 111.1 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -84.58 -15.46 45.57 Favored 'General case' 0 C--O 1.23 0.053 0 O-C-N 121.157 -0.964 . . . . 0.0 109.109 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 ' CD2' ' A' ' 90' ' ' TYR . 95.4 t -77.18 114.04 17.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 178.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 -68.09 -61.26 1.94 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 124.915 1.286 . . . . 0.0 109.5 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.2 169.47 20.71 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.402 1.001 . . . . 0.0 110.502 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 p -71.58 151.72 43.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD12 ' A' ' 82' ' ' LEU . 3.8 ttmt -118.58 -38.78 3.08 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.492 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 t -147.57 140.87 19.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 118.548 0.613 . . . . 0.0 111.905 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -113.88 93.95 4.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 125.596 1.558 . . . . 0.0 107.875 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -140.24 156.46 46.48 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 128.35 2.66 . . . . 0.0 105.549 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -131.01 126.49 36.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.291 1.836 . . . . 0.0 108.709 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE3' HD23 ' A' ' 71' ' ' LEU . 0.6 OUTLIER -147.37 129.99 15.96 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.454 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 tt -134.55 144.51 48.03 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.977 1.711 . . . . 0.0 108.175 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.45 169.88 23.6 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 125.918 1.687 . . . . 0.0 107.8 178.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -128.01 134.71 64.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 119.56 1.073 . . . . 0.0 108.343 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.63 133.68 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 125.061 1.344 . . . . 0.0 110.617 -178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -71.69 119.3 15.65 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.858 2.063 . . . . 0.0 108.506 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.1 mtp -68.72 -17.34 64.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.871 0.76 . . . . 0.0 112.684 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.468 ' HE2' ' HA ' ' A' ' 54' ' ' LYS . 7.4 mmpt? -79.81 -53.93 6.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.302 1.41 . . . . 0.0 112.47 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.6 m -97.31 -7.72 31.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 66.31 14.91 9.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.018 1.727 . . . . 0.0 110.846 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -99.11 155.25 17.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 125.631 1.572 . . . . 0.0 111.454 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.409 ' CD2' ' HA2' ' A' ' 14' ' ' GLY . 5.5 mp -74.0 157.46 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 177.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.7 mt -126.68 -174.4 3.12 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.794 1.238 . . . . 0.0 112.091 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -13.77 15.92 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.465 1.906 . . . . 0.0 113.525 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 p -149.37 -172.41 4.13 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.615 1.166 . . . . 0.0 108.505 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.5 t -113.86 106.82 14.9 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -109.41 164.41 12.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 125.187 1.395 . . . . 0.0 109.061 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -10.96 6.04 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.682 1.593 . . . . 0.0 114.732 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.03 14.71 20.81 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.583 1.083 . . . . 0.0 109.001 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 t -131.87 167.18 20.04 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.51 1.524 . . . . 0.0 109.898 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -140.87 135.23 33.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 125.215 1.406 . . . . 0.0 109.0 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 t -79.43 142.9 35.5 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.8 mt -132.85 133.16 42.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -113.16 103.44 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 103.228 -2.879 . . . . 0.0 103.228 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.504 HD23 ' HE3' ' A' ' 47' ' ' LYS . 1.9 mm? -97.93 91.89 5.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 -178.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -164.87 -163.76 0.74 Allowed 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 54.13 67.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.963 0.887 . . . . 0.0 112.109 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.7 mt -80.79 133.71 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.346 -0.846 . . . . 0.0 110.239 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -133.39 169.71 16.54 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.566 1.946 . . . . 0.0 110.093 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -117.66 150.31 39.26 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.881 2.072 . . . . 0.0 109.745 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.99 168.49 9.02 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 126.86 2.064 . . . . 0.0 110.214 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.5 m -53.85 -37.95 64.17 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.242 1.017 . . . . 0.0 113.449 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -85.76 11.91 10.1 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 126.136 1.775 . . . . 0.0 113.211 -177.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.7 mptt 74.73 1.21 3.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.921 1.689 . . . . 0.0 110.223 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.8 t -71.21 152.33 43.45 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 104.821 -2.288 . . . . 0.0 104.821 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -109.28 153.17 24.25 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.628 0.771 . . . . 0.0 109.744 -178.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.6 p -139.62 168.33 20.06 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.517 1.127 . . . . 0.0 109.647 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.9 ttm -133.83 138.35 45.6 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.075 1.75 . . . . 0.0 109.703 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.27 118.84 4.71 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 127.279 2.371 . . . . 0.0 111.184 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.7 mt -137.0 119.66 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 51.48 44.21 29.15 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.625 0.77 . . . . 0.0 109.264 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 56.6 m-20 62.41 17.83 9.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.054 2.142 . . . . 0.0 114.676 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -118.48 131.27 56.25 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 124.371 1.068 . . . . 0.0 109.113 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.409 ' CD2' HG21 ' A' ' 38' ' ' VAL . 14.2 m-85 -86.74 116.29 24.74 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 122.338 0.255 . . . . 0.0 111.031 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -109.08 123.63 49.48 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.272 2.229 . . . . 0.0 109.547 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -59.92 142.38 53.77 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.725 1.61 . . . . 0.0 111.289 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -110.45 133.66 55.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -129.36 163.42 46.45 Favored Pre-proline 0 N--CA 1.468 0.459 0 C-N-CA 125.886 1.675 . . . . 0.0 110.999 -177.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.59 152.22 37.82 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.68 2.253 . . . . 0.0 111.084 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.4 -6.34 4.72 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -15.44 59.69 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.63 -1.293 . . . . 0.0 110.929 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -73.01 -4.25 31.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -45.71 138.76 4.45 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 127.15 2.18 . . . . 0.0 111.06 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 101.77 -26.81 23.1 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.92 -18.62 8.16 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.402 1.081 . . . . 0.0 111.985 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -140.74 157.11 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -145.93 167.44 23.28 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 127.039 2.135 . . . . 0.0 107.767 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.18 162.46 5.86 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.258 0.623 . . . . 0.0 110.561 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.98 168.64 13.3 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.891 -0.506 . . . . 0.0 111.502 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -111.7 139.72 46.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.972 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.3 mp -68.82 -13.35 62.36 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 123.836 0.854 . . . . 0.0 111.019 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -60.27 -23.04 63.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.174 0.99 . . . . 0.0 111.943 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -71.47 -7.48 47.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.341 1.056 . . . . 0.0 110.99 -177.114 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.236 0.388 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.403 HG21 HD12 ' A' ' 74' ' ' ILE . 84.8 t -112.23 144.7 19.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -119.44 96.93 5.41 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -76.22 155.09 34.74 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.197 -2.149 . . . . 0.0 105.197 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -62.39 -33.33 74.55 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 74.41 123.95 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.919 2.088 . . . . 0.0 110.431 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.83 35.07 38.5 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.466 1.031 . . . . 0.0 113.533 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -140.17 -179.65 6.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.172 2.589 . . . . 0.0 109.335 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -72.67 -168.35 0.44 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.287 2.235 . . . . 0.0 111.27 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.277 22.0 p -79.21 118.18 20.91 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -176.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -169.28 140.5 2.36 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 126.781 2.032 . . . . 0.0 108.218 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.478 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.9 p90 -160.68 169.61 22.49 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.22 126.65 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 107.661 -1.236 . . . . 0.0 107.661 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -138.43 136.1 35.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.2 t0 55.16 41.39 31.59 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.011 1.325 . . . . 0.0 112.271 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 59.77 28.16 17.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.507 1.523 . . . . 0.0 111.644 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -130.95 142.76 50.38 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.403 1.081 . . . . 0.0 110.993 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.1 m -70.19 126.59 30.11 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.366 1.866 . . . . 0.0 107.767 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.478 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 5.5 m-85 -137.57 160.23 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.996 0.918 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.46 ' CE2' HG22 ' A' ' 29' ' ' THR . 21.8 p90 -149.63 165.29 32.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.998 0.919 . . . . 0.0 109.007 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' ILE . 41.5 t -94.65 128.64 45.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.916 -0.49 . . . . 0.0 109.779 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 27' ' ' PHE . 17.6 p -96.27 166.47 11.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.001 1.32 . . . . 0.0 111.962 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -76.87 -10.03 59.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.021 1.328 . . . . 0.0 112.443 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -71.69 98.94 2.02 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.396 1.479 . . . . 0.0 108.038 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -89.98 142.92 27.24 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.12 140.87 26.2 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.963 1.705 . . . . 0.0 107.966 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.26 149.18 50.91 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.247 1.965 . . . . 0.0 109.909 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -57.71 -23.55 52.35 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -73.14 -23.67 60.5 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.931 -0.481 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -87.47 -14.82 39.4 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.654 1.182 . . . . 0.0 109.976 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.98 122.73 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -73.21 -61.51 1.79 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.5 p-10 -167.09 168.35 13.72 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.931 1.292 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.1 p -65.14 160.36 21.41 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HE3' HD12 ' A' ' 82' ' ' LEU . 20.5 ttmm -128.21 -50.01 1.31 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 117.492 -1.242 . . . . 0.0 111.347 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -143.2 136.65 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 120.021 1.282 . . . . 0.0 111.691 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mtmm -104.24 114.83 29.34 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.613 1.965 . . . . 0.0 109.201 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -146.8 157.91 43.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 127.613 2.365 . . . . 0.0 108.988 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 108.29 5.65 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.274 0.943 . . . . 0.0 110.58 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.19 142.24 27.08 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.8 tt -135.15 145.27 47.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 127.979 2.512 . . . . 0.0 109.382 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.48 170.37 17.0 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.89 1.676 . . . . 0.0 108.755 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.98 136.73 59.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 125.49 1.516 . . . . 0.0 108.621 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -137.19 134.77 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.285 0.634 . . . . 0.0 109.956 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.587 ' HB2' HD11 ' A' ' 59' ' ' LEU . 11.4 t0 -79.81 125.35 29.59 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.403 1.081 . . . . 0.0 108.458 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 81.7 mtp -65.94 -16.22 63.67 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.965 1.257 . . . . 0.0 112.934 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -63.36 -53.79 47.03 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.094 0.861 . . . . 0.0 111.719 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 t -122.69 9.44 9.54 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 56.53 38.21 29.45 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.767 1.167 . . . . 0.0 110.085 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -105.86 143.03 34.58 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 125.223 1.409 . . . . 0.0 108.676 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.72 153.72 41.03 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.819 0.818 . . . . 0.0 111.092 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.587 HD11 ' HB2' ' A' ' 52' ' ' ASP . 31.7 mt -135.25 157.6 46.49 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.629 -1.168 . . . . 0.0 110.803 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.24 -20.88 33.7 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.815 1.246 . . . . 0.0 110.973 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 m -149.22 140.32 23.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.077 0.951 . . . . 0.0 108.454 -178.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.64 119.0 19.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.551 1.54 . . . . 0.0 110.404 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -107.28 172.0 7.07 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 126.329 1.852 . . . . 0.0 107.438 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -56.74 -26.45 57.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.717 1.376 . . . . 0.0 114.717 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -92.86 4.17 54.36 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.491 0.716 . . . . 0.0 111.754 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 43.0 t -117.62 166.69 12.1 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.569 1.548 . . . . 0.0 113.314 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.5 t -137.53 148.25 25.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 127.046 2.139 . . . . 0.0 106.545 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -101.91 143.4 31.85 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -130.86 136.82 49.0 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 t -116.04 101.96 12.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.72 96.7 9.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.915 1.286 . . . . 0.0 107.957 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.58 -161.76 0.25 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 118.41 0.55 . . . . 0.0 112.398 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.8 t30 52.42 66.76 1.12 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.639 1.976 . . . . 0.0 112.281 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.403 HD12 HG21 ' A' ' 9' ' ' VAL . 2.3 mt -81.55 135.12 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.184 -0.948 . . . . 0.0 111.277 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -139.36 161.97 36.15 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.637 1.975 . . . . 0.0 109.729 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -104.67 155.43 18.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.517 1.527 . . . . 0.0 108.606 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.59 163.92 12.82 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.419 1.887 . . . . 0.0 109.75 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.1 p -57.76 -34.2 69.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.378 0.671 . . . . 0.0 112.809 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -80.55 11.63 3.62 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.038 0.935 . . . . 0.0 110.582 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 71.19 12.04 6.83 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 127.878 2.471 . . . . 0.0 110.29 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.13 167.14 20.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.433 HD12 ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -119.12 148.4 43.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.637 1.175 . . . . 0.0 109.553 -178.235 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 17.5 p -147.2 167.23 24.72 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.476 0.71 . . . . 0.0 110.161 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.4 ttm -133.85 137.55 45.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 126.313 1.845 . . . . 0.0 108.198 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.54 121.2 5.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 125.298 1.428 . . . . 0.0 109.82 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.0 mt -136.72 120.62 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 51.42 51.22 17.26 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.586 1.954 . . . . 0.0 110.103 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t0 59.86 15.89 5.26 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.015 1.726 . . . . 0.0 114.134 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -121.09 139.18 53.67 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 125.266 1.426 . . . . 0.0 109.389 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -96.72 116.43 29.12 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 118.331 0.514 . . . . 0.0 111.391 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -106.89 125.84 51.53 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.26 1.424 . . . . 0.0 109.491 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -60.71 146.32 46.22 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.155 0.982 . . . . 0.0 109.697 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 28' ' ' VAL . 1.3 pt -115.9 132.93 63.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -129.19 165.16 34.34 Favored Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 124.713 1.205 . . . . 0.0 112.33 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.96 148.81 32.14 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.819 2.346 . . . . 0.0 110.176 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -58.65 -15.32 11.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.404 0.682 . . . . 0.0 112.703 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.2 m -72.66 -14.91 61.69 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 120.762 -1.211 . . . . 0.0 112.055 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.42 -4.07 43.48 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.799 -1.188 . . . . 0.0 111.445 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -53.96 150.24 8.07 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.994 1.318 . . . . 0.0 108.941 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.6 1.81 63.7 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -148.86 -49.89 0.15 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.018 2.527 . . . . 0.0 106.259 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 t -109.3 161.51 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.152 0.981 . . . . 0.0 109.068 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -150.67 170.51 19.01 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 127.097 2.159 . . . . 0.0 108.864 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.62 169.11 2.54 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.203 1.001 . . . . 0.0 112.174 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.31 174.94 9.57 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.587 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.1 mtt85 -125.12 141.69 51.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 O-C-N 121.887 -0.508 . . . . 0.0 110.79 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.579 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.4 OUTLIER -63.12 -22.04 66.59 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.312 1.045 . . . . 0.0 110.936 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -57.29 -16.57 8.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -76.77 -3.11 36.52 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.336 0.655 . . . . 0.0 110.495 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.253 1.252 0 C-N-CA 127.719 2.408 . . . . 0.0 107.729 -178.987 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? . . . . . 0 C--O 1.234 0.271 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -104.07 130.45 54.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -98.23 111.94 24.09 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -87.04 158.88 19.13 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.85 -33.93 75.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 75.2 128.11 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.352 2.261 . . . . 0.0 112.348 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.99 34.83 39.32 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 125.737 1.637 . . . . 0.0 112.249 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.9 m -139.89 178.47 7.23 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 125.928 1.691 . . . . 0.0 112.096 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -73.65 -169.45 0.7 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.116 1.767 . . . . 0.0 108.764 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.6 p -79.67 120.88 24.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 119.658 -1.901 . . . . 0.0 110.574 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -168.23 144.41 3.84 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 130.172 3.389 . . . . 0.0 106.596 178.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 31.7 p90 -165.79 165.43 18.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.5 mp -120.57 131.3 73.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 123.784 0.834 . . . . 0.0 109.148 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -144.45 143.91 31.12 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 50.64 34.31 9.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 112.638 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 58.01 33.52 23.28 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 112.384 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -130.61 146.3 52.09 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.062 1.745 . . . . 0.0 106.864 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 m -74.44 140.81 44.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.8 m-85 -139.54 159.23 42.65 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 125.643 1.577 . . . . 0.0 109.523 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -148.91 165.69 30.8 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.021 -1.05 . . . . 0.0 109.799 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.9 t -101.26 128.24 53.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 p -99.71 172.39 7.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.356 1.462 . . . . 0.0 109.05 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -78.05 -15.58 58.79 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.624 1.97 . . . . 0.0 112.273 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -67.31 116.33 7.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.514 1.126 . . . . 0.0 110.681 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.24 148.26 23.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.969 1.708 . . . . 0.0 111.47 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.489 HD11 ' CD ' ' A' ' 92' ' ' LYS . 23.6 mm -116.4 127.77 26.5 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 126.594 1.958 . . . . 0.0 109.419 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.63 146.74 68.25 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.7 2.267 . . . . 0.0 109.477 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -55.93 -27.64 53.2 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.6 -23.78 67.52 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.535 0.734 . . . . 0.0 111.574 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -95.12 -19.07 20.41 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.63 139.21 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -93.36 -60.94 1.66 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.258 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -163.43 166.04 23.22 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.65 0.78 . . . . 0.0 111.668 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 p -70.76 126.74 30.42 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -101.51 -42.16 6.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 55.3 t -142.64 127.95 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 119.105 0.866 . . . . 0.0 108.877 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -100.38 117.37 34.43 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -149.93 157.08 42.82 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 131.282 3.833 . . . . 0.0 105.197 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -137.21 115.39 11.67 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 104.052 -2.574 . . . . 0.0 104.052 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -146.77 133.52 20.01 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.6 tt -137.58 145.63 43.08 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.876 1.67 . . . . 0.0 108.215 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.88 169.31 25.06 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 125.909 1.683 . . . . 0.0 106.48 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.5 mt -127.97 137.41 57.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 C-N-CA 125.617 1.567 . . . . 0.0 107.111 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -130.55 140.22 49.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.71 126.98 33.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 84.2 mtp -67.62 -18.69 65.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -72.22 -44.61 62.67 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -122.13 0.84 9.68 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.61 30.28 18.56 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.885 1.274 . . . . 0.0 111.068 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -99.05 147.05 25.43 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.88 0.872 . . . . 0.0 110.0 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.91 146.95 43.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mp -124.43 177.58 5.83 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.379 1.472 . . . . 0.0 110.397 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 t -116.9 -3.25 11.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.978 1.311 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 p -144.7 162.34 36.96 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 120.219 1.372 . . . . 0.0 109.129 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.8 t -92.76 115.4 28.08 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -124.44 161.59 25.71 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -56.45 -19.93 17.49 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -93.08 -4.33 52.58 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.92 0.888 . . . . 0.0 110.753 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 m -113.7 160.09 19.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.484 1.514 . . . . 0.0 113.771 -176.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 25.3 t -137.07 146.59 27.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 125.191 1.397 . . . . 0.0 108.826 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -85.75 141.37 29.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -129.98 100.75 5.56 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 105.887 -1.894 . . . . 0.0 105.887 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.87 102.41 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 103.203 -2.888 . . . . 0.0 103.203 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.32 93.71 8.35 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -164.37 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.656 -0.418 . . . . 0.0 112.005 -176.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 47.1 67.38 0.8 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.012 1.725 . . . . 0.0 111.723 177.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.2 mt -77.45 140.12 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.538 -1.351 . . . . 0.0 109.591 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -134.15 169.67 16.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.753 2.021 . . . . 0.0 111.01 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -113.06 170.8 7.95 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.017 2.127 . . . . 0.0 109.601 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.61 161.24 26.67 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.747 2.019 . . . . 0.0 108.272 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -60.57 -26.88 67.27 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.504 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -93.53 28.49 2.27 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.49 1.916 . . . . 0.0 111.32 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 59.35 3.19 0.36 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.328 1.851 . . . . 0.0 112.93 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.7 m -73.49 152.86 40.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.49 150.09 35.37 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.297 0.639 . . . . 0.0 110.773 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.0 p -144.69 169.44 18.0 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.901 0.88 . . . . 0.0 110.619 178.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.0 ttm -134.46 136.24 43.06 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 126.391 1.876 . . . . 0.0 109.328 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.48 110.38 3.28 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 125.502 1.525 . . . . 0.0 111.439 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.2 mt -123.68 119.16 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 49.49 51.81 15.69 Favored 'General case' 0 C--O 1.23 0.076 0 C-N-CA 124.689 1.195 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 70.31 -6.22 1.2 Allowed 'General case' 0 C--O 1.24 0.561 0 C-N-CA 128.046 2.538 . . . . 0.0 115.525 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -105.41 133.74 49.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.396 1.453 . . . . 0.0 110.646 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -85.67 116.66 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.455 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -115.85 132.53 56.61 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.504 1.122 . . . . 0.0 112.219 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.587 ' HE3' HD21 ' A' ' 94' ' ' LEU . 2.2 mtpp -60.53 142.38 55.41 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.833 1.253 . . . . 0.0 111.19 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.7 135.5 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.587 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.0 mm? -130.18 159.3 71.01 Favored Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 123.954 0.902 . . . . 0.0 108.818 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.0 161.18 45.32 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.312 2.008 . . . . 0.0 109.831 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.17 -13.07 32.77 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 110.472 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -63.34 -24.36 67.82 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.216 1.806 . . . . 0.0 109.555 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -10.69 59.99 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.828 1.251 . . . . 0.0 111.183 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.9 mmtt -59.26 161.49 5.42 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 120.682 -1.261 . . . . 0.0 109.941 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.7 -35.11 4.18 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -124.15 -5.92 7.81 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.3 t -135.51 156.81 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 126.515 1.926 . . . . 0.0 105.863 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -138.6 165.45 26.87 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.892 1.677 . . . . 0.0 108.131 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.88 166.42 15.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.02 167.31 10.04 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -106.89 132.29 53.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 125.886 1.674 . . . . 0.0 110.474 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mt -67.38 -21.41 65.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.311 0.644 . . . . 0.0 109.984 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -60.07 -20.42 58.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.901 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -67.09 -16.93 64.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.97 0.804 . . . . 0.0 112.293 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.691 1.996 . . . . 0.0 111.33 -177.387 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.7 t -64.44 143.71 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 O-C-N 121.825 -0.547 . . . . 0.0 110.183 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -117.12 105.6 12.44 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -84.63 153.61 23.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -67.18 -33.96 76.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.571 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 63.31 135.62 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.93 3.292 . . . . 0.0 112.408 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.95 24.35 74.4 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m -138.83 178.64 7.01 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.706 2.002 . . . . 0.0 112.286 -178.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.44 -169.02 0.6 Allowed 'General case' 0 C--O 1.24 0.599 0 C-N-CA 129.096 2.958 . . . . 0.0 107.694 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.258 35.2 p -79.32 119.39 22.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 117.534 -1.666 . . . . 0.0 108.324 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -169.2 147.74 3.83 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 130.212 3.405 . . . . 0.0 107.033 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -168.13 171.41 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 126.351 1.86 . . . . 0.0 107.979 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -126.68 127.74 70.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 42.7 t80 -141.08 147.24 38.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 4.9 t70 54.92 32.15 17.35 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.252 1.821 . . . . 0.0 109.691 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 66.64 15.56 10.15 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 127.576 2.35 . . . . 0.0 113.357 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -123.66 154.77 38.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 124.395 1.078 . . . . 0.0 109.588 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.1 t -79.34 141.93 36.52 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -144.59 155.78 43.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.711 2.004 . . . . 0.0 111.493 -178.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -148.8 151.23 34.42 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 120.904 -1.122 . . . . 0.0 110.529 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 t -81.11 127.96 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 123.997 0.919 . . . . 0.0 110.626 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.3 p -98.14 164.4 12.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.803 1.241 . . . . 0.0 109.035 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.68 -12.37 61.3 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 126.506 1.922 . . . . 0.0 113.295 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.95 112.31 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.584 1.553 . . . . 0.0 109.208 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.402 ' C ' HD12 ' A' ' 33' ' ' ILE . 16.7 tt0 -96.83 146.92 24.46 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.719 0.808 . . . . 0.0 109.451 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.402 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.04 135.22 22.08 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.604 1.962 . . . . 0.0 109.139 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.3 151.58 29.88 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.452 2.768 . . . . 0.0 111.564 178.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -58.5 -22.6 55.59 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.528 0.731 . . . . 0.0 112.749 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -67.45 -25.84 66.1 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.937 -0.477 . . . . 0.0 110.517 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.63 -20.01 23.02 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 111.399 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.1 t -65.13 126.15 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -83.47 -61.3 1.88 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.733 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -163.87 168.95 18.86 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 126.159 1.783 . . . . 0.0 109.16 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.441 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 15.9 m -63.16 155.35 28.36 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.155 0.982 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -120.42 -54.73 2.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.737 -0.602 . . . . 0.0 110.592 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.2 t -146.99 146.81 18.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.58 125.38 53.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 104.047 -2.575 . . . . 0.0 104.047 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 158.43 44.06 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 126.274 1.83 . . . . 0.0 111.343 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.87 112.83 15.15 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.859 ' HE3' HD23 ' A' ' 49' ' ' LEU . 4.0 tmtm? -147.99 115.9 6.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.45 1.1 . . . . 0.0 109.113 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -131.78 134.77 46.2 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.112 1.365 . . . . 0.0 107.823 178.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.859 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -148.53 170.97 16.88 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.853 1.661 . . . . 0.0 108.425 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -129.28 129.6 67.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.5 t -120.93 134.03 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.67 1.188 . . . . 0.0 108.966 -178.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' A' ' 59' ' ' LEU . 3.9 t70 -80.68 126.03 30.77 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.03 -1.043 . . . . 0.0 109.574 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 76.5 mtp -68.23 -17.79 64.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.608 1.549 . . . . 0.0 113.808 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -65.0 -52.03 58.37 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.164 0.893 . . . . 0.0 111.094 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -122.19 6.25 9.71 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 60.66 24.79 14.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.484 1.514 . . . . 0.0 112.353 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.557 ' HE3' ' HA ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -93.27 151.15 19.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 120.931 -1.106 . . . . 0.0 109.157 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.485 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -70.8 146.21 49.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' A' ' 52' ' ' ASP . 50.6 mt -130.42 -179.59 5.35 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.328 2.251 . . . . 0.0 108.253 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.8 m -131.78 -5.06 3.62 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.693 1.197 . . . . 0.0 112.281 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -123.71 174.63 7.36 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.041 1.736 . . . . 0.0 106.963 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 t -109.28 110.44 21.63 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.262 87.5 m-20 -102.65 159.38 15.51 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.355 1.462 . . . . 0.0 107.747 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -70.52 -12.87 61.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.211 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -100.62 5.52 43.9 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.439 1.472 . . . . 0.0 110.55 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.7 t -113.78 173.75 6.27 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.012 1.725 . . . . 0.0 112.053 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.5 t -142.59 130.41 19.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 125.731 1.612 . . . . 0.0 107.784 178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -75.04 135.09 41.27 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -125.84 132.33 52.24 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 120.8 -1.187 . . . . 0.0 108.332 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -113.31 107.84 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.53 92.04 3.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.909 1.232 . . . . 0.0 110.981 -178.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -168.14 -164.34 0.53 Allowed 'General case' 0 CA--C 1.508 -0.672 0 O-C-N 121.199 -0.938 . . . . 0.0 111.736 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.94 66.79 0.87 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 123.882 0.739 . . . . 0.0 111.636 176.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 6.7 mt -79.61 138.61 19.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.3 m-85 -134.69 168.83 18.3 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.13 1.772 . . . . 0.0 107.768 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -110.9 157.9 19.34 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.486 1.514 . . . . 0.0 108.141 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.77 162.59 17.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 125.348 1.459 . . . . 0.0 109.457 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.1 t -56.42 -29.98 62.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.486 0.714 . . . . 0.0 111.098 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -85.08 12.29 8.04 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.82 -1.175 . . . . 0.0 112.517 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm 75.3 1.99 3.79 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.546 1.939 . . . . 0.0 110.462 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 m -74.72 167.69 21.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.439 1.096 . . . . 0.0 110.108 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.78 148.58 45.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.492 1.117 . . . . 0.0 110.204 -178.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.4 p -140.2 171.07 14.69 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.08 0.952 . . . . 0.0 109.414 178.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.5 ttm -131.36 134.65 46.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.357 1.863 . . . . 0.0 110.718 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.24 103.78 2.53 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 126.743 2.116 . . . . 0.0 110.573 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 65.7 mt -117.43 113.97 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.899 1.68 . . . . 0.0 108.074 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 33.5 m120 47.84 54.01 10.57 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 124.743 1.217 . . . . 0.0 112.585 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 75.21 -4.64 2.33 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.518 1.927 . . . . 0.0 115.473 178.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -115.85 147.48 40.99 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.378 1.445 . . . . 0.0 109.626 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -99.85 116.92 33.04 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -108.09 133.44 52.37 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.964 1.305 . . . . 0.0 111.176 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -67.87 151.09 47.72 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.19 -0.944 . . . . 0.0 110.059 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -118.58 133.66 64.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -119.59 156.75 53.25 Favored Pre-proline 0 N--CA 1.467 0.39 0 C-N-CA 125.238 1.415 . . . . 0.0 108.848 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.51 156.1 64.93 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.483 2.122 . . . . 0.0 109.888 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.36 65.18 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.577 -0.702 . . . . 0.0 109.68 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.0 t -70.88 -0.7 9.71 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.107 0.963 . . . . 0.0 110.516 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.97 -3.77 31.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.033 -1.667 . . . . 0.0 112.959 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -53.05 164.41 0.41 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.606 1.193 . . . . 0.0 112.701 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.62 -41.77 3.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 125.118 1.342 . . . . 0.0 111.823 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.75 -28.24 19.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.417 1.087 . . . . 0.0 110.573 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.9 p -134.02 162.9 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 127.38 2.272 . . . . 0.0 106.402 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -134.39 172.56 12.72 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.818 2.447 . . . . 0.0 106.875 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.68 168.71 14.3 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.23 172.51 6.85 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.711 -0.618 . . . . 0.0 112.46 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -118.22 138.88 52.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.341 1.056 . . . . 0.0 110.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.403 HD12 ' H ' ' A' ' 107' ' ' LEU . 1.6 mp -70.85 -13.13 61.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.162 0.585 . . . . 0.0 110.04 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -61.48 -10.13 7.11 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.243 2.217 . . . . 0.0 113.18 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -96.1 -4.65 42.45 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.726 0.81 . . . . 0.0 112.706 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 C--O 1.25 1.099 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.226 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.2 t -99.13 137.15 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -102.46 103.05 13.4 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 103.688 -2.708 . . . . 0.0 103.688 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -80.59 166.63 20.94 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.493 1.117 . . . . 0.0 110.697 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 2.2 p30 -59.24 -33.58 71.18 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.709 1.604 . . . . 0.0 113.798 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 51.19 91.96 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.101 2.56 . . . . 0.0 113.477 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 65.07 38.7 95.67 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 113.748 -1.569 . . . . 0.0 111.904 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 5.0 m -139.38 -179.89 6.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.349 2.259 . . . . 0.0 109.647 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.66 -170.07 0.8 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.617 1.567 . . . . 0.0 108.358 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 33.8 p -79.49 121.76 25.6 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 123.994 1.854 . . . . 0.0 110.438 -175.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -167.14 149.42 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 129.584 3.154 . . . . 0.0 107.234 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.47 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 38.8 p90 -164.27 167.27 20.11 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -131.53 112.83 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 O-C-N 120.452 -1.405 . . . . 0.0 108.278 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.416 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 86.9 t80 -117.55 137.07 52.83 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.067 0.947 . . . . 0.0 108.608 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.416 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 3.3 t70 55.25 34.22 22.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.175 1.79 . . . . 0.0 114.042 179.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 69.78 17.65 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.844 2.458 . . . . 0.0 111.933 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -119.08 138.24 53.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.963 1.705 . . . . 0.0 106.944 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.2 m -82.42 136.95 34.83 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -137.67 166.41 24.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.561 1.944 . . . . 0.0 112.125 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -148.99 163.66 36.86 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.495 0.718 . . . . 0.0 110.725 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 t -96.01 122.52 47.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 124.785 1.234 . . . . 0.0 108.466 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.78 172.82 7.01 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.517 1.127 . . . . 0.0 110.009 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -74.9 -14.98 60.71 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HE2' HG23 ' A' ' 102' ' ' VAL . 0.0 OUTLIER -69.51 110.95 5.03 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.065 0.946 . . . . 0.0 110.315 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.19 146.81 24.38 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.36 1.064 . . . . 0.0 108.524 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.6 mp -117.71 137.17 24.02 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 126.528 1.931 . . . . 0.0 105.946 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.6 153.05 49.02 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.447 2.098 . . . . 0.0 111.47 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.21 -30.19 64.36 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -65.9 -15.6 63.09 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.783 0.719 . . . . 0.0 112.686 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -97.9 -14.44 20.67 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.988 0.915 . . . . 0.0 111.14 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.405 HG21 ' CD2' ' A' ' 90' ' ' TYR . 69.9 t -78.23 135.35 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 C-N-CA 124.602 1.161 . . . . 0.0 108.001 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -91.66 -61.34 1.66 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.359 1.464 . . . . 0.0 111.038 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -156.23 158.71 38.01 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.7 t -70.45 131.43 44.04 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttp -101.12 -51.93 3.4 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 117.153 -1.403 . . . . 0.0 114.535 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.9 t -141.39 133.48 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 119.027 0.831 . . . . 0.0 110.191 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.21 117.2 33.43 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.335 1.054 . . . . 0.0 109.445 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -148.77 157.44 43.44 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.628 1.971 . . . . 0.0 110.128 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -123.3 120.71 33.88 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.963 -1.085 . . . . 0.0 108.398 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.4 tptm -147.51 124.02 11.05 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.725 1.21 . . . . 0.0 107.818 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 tt -134.19 143.96 48.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.623 1.969 . . . . 0.0 109.407 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -153.72 169.57 23.0 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 125.369 1.468 . . . . 0.0 107.838 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mt -130.33 133.82 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 125.192 1.397 . . . . 0.0 107.443 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.19 152.49 33.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 125.738 1.615 . . . . 0.0 108.129 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -88.89 124.83 34.58 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.347 1.859 . . . . 0.0 107.327 178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.9 mtp -68.35 -25.95 65.35 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 121.009 1.731 . . . . 0.0 109.863 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -53.56 54.09 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.362 1.065 . . . . 0.0 112.677 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -111.34 -6.14 14.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 65.0 20.2 12.05 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.819 1.19 . . . . 0.0 111.308 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -102.27 153.89 19.55 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.79 1.636 . . . . 0.0 108.637 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.77 154.59 39.51 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.335 0.516 . . . . 0.0 111.393 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.2 mt -135.56 160.28 38.98 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 125.791 1.636 . . . . 0.0 108.809 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -7.98 45.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.4 m -142.18 165.57 27.08 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.737 1.608 . . . . 0.0 110.071 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.4 p -92.39 117.01 29.48 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -132.23 163.06 29.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -47.38 -34.59 7.2 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -178.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -80.08 -7.1 58.71 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.829 -1.169 . . . . 0.0 112.634 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.8 t -120.55 164.28 16.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 127.346 2.258 . . . . 0.0 114.035 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -137.32 161.38 34.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 127.012 2.125 . . . . 0.0 106.353 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.1 t -110.87 144.84 39.29 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.016 1.327 . . . . 0.0 109.487 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.1 mt -131.19 144.72 51.56 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.0 t -122.94 101.73 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 101.658 -3.46 . . . . 0.0 101.658 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -87.87 96.07 10.34 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -178.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -169.01 -161.62 0.33 Allowed 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.59 66.93 1.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.639 1.576 . . . . 0.0 111.455 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 mt -79.36 137.1 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.166 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -134.99 168.86 18.34 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.967 1.707 . . . . 0.0 109.212 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -116.96 147.1 42.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.31 168.47 10.0 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 126.251 1.82 . . . . 0.0 110.637 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.9 t -60.31 -35.15 74.93 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -83.15 18.2 1.78 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.986 1.314 . . . . 0.0 112.178 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 65.26 12.5 8.09 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.256 1.422 . . . . 0.0 110.43 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.8 t -81.29 169.29 17.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.4 mt -123.55 154.99 38.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.413 0.685 . . . . 0.0 112.377 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.4 p -146.98 171.78 14.72 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.901 0.88 . . . . 0.0 110.035 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.2 ttm -133.58 135.98 44.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.368 1.867 . . . . 0.0 108.651 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.0 115.74 4.17 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 126.174 1.845 . . . . 0.0 112.865 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -132.76 122.84 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 55.7 36.92 28.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.39 1.876 . . . . 0.0 110.777 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 t0 70.02 13.82 7.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.14 2.176 . . . . 0.0 114.173 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -116.48 138.54 51.3 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.843 1.657 . . . . 0.0 107.823 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD2' HG21 ' A' ' 38' ' ' VAL . 18.6 m-85 -91.2 116.88 29.17 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.798 -0.564 . . . . 0.0 110.448 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -106.07 124.56 49.77 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.224 1.409 . . . . 0.0 107.597 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.401 ' HB2' HD13 ' A' ' 33' ' ' ILE . 11.1 ttpp -60.53 157.51 14.1 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.157 -0.964 . . . . 0.0 111.307 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.47 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -121.99 134.54 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.01 158.74 67.87 Favored Pre-proline 0 N--CA 1.469 0.484 0 C-N-CA 125.093 1.357 . . . . 0.0 107.877 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.08 153.69 67.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.161 1.907 . . . . 0.0 109.171 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 99' ' ' LYS . 17.2 pt-20 -65.53 -19.79 66.07 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 119.892 -0.723 . . . . 0.0 110.747 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -63.82 -19.46 65.04 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.266 1.426 . . . . 0.0 110.894 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -84.88 2.17 43.84 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 96' ' ' GLU . 36.3 mtmt -55.5 154.6 6.25 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.883 0.765 . . . . 0.0 110.033 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.76 -21.72 35.7 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.078 0.847 . . . . 0.0 111.83 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.15 -12.43 6.91 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 118.86 1.33 . . . . 0.0 111.182 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.416 HG23 ' HE2' ' A' ' 31' ' ' LYS . 3.8 p -141.35 155.86 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 C-N-CA 125.655 1.582 . . . . 0.0 107.286 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -130.06 164.73 23.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.999 1.72 . . . . 0.0 108.211 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 164.6 12.99 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.48 160.0 11.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.386 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -107.35 133.18 52.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 124.217 1.007 . . . . 0.0 111.275 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.47 -23.06 67.15 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.759 1.224 . . . . 0.0 110.041 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.11 -9.2 2.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.042 1.337 . . . . 0.0 113.664 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -84.43 -8.04 59.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.18 0.992 . . . . 0.0 111.053 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 C--O 1.245 0.86 0 C-N-CA 124.367 1.067 . . . . 0.0 111.17 -176.602 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.536 0.438 0 CA-C-O 121.507 0.67 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.6 t -102.47 115.75 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 102.476 -3.157 . . . . 0.0 102.476 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -80.49 113.75 18.89 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.24 150.5 25.41 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -71.56 -34.05 69.63 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 119.636 -0.826 . . . . 0.0 111.358 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 66.51 137.44 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 128.174 2.59 . . . . 0.0 112.508 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.9 26.04 39.61 Favored Glycine 0 CA--C 1.533 1.172 0 O-C-N 121.294 -0.879 . . . . 0.0 113.202 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 m -140.26 177.68 7.82 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.519 1.928 . . . . 0.0 111.291 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.06 -168.33 0.61 Allowed 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.564 2.345 . . . . 0.0 107.025 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -79.85 121.87 25.95 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.781 -1.824 . . . . 0.0 110.113 -176.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -167.26 146.68 5.2 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 130.792 3.637 . . . . 0.0 105.646 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -168.79 167.4 11.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.259 1.424 . . . . 0.0 108.226 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.5 mt -130.92 113.22 23.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 O-C-N 121.595 -0.691 . . . . 0.0 109.251 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -120.01 139.98 51.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 53.27 33.2 14.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 123.029 1.395 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 56.84 30.14 17.32 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.034 2.534 . . . . 0.0 111.632 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.9 mtpp -123.16 132.37 54.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.682 1.993 . . . . 0.0 105.634 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.5 p -71.45 139.67 49.73 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -145.66 163.08 35.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.156 1.782 . . . . 0.0 109.385 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 p90 -149.14 162.02 40.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -95.75 127.04 48.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.407 HG21 HD23 ' A' ' 94' ' ' LEU . 26.3 p -96.57 171.86 8.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.693 1.597 . . . . 0.0 110.574 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.42 -10.25 59.35 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.542 1.937 . . . . 0.0 112.41 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.09 103.55 1.56 Allowed 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 126.081 1.752 . . . . 0.0 110.173 -179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.418 ' C ' HD12 ' A' ' 33' ' ' ILE . 31.3 tt0 -94.29 142.25 27.63 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.418 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.9 mp -116.21 142.63 29.62 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 124.331 1.052 . . . . 0.0 109.389 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 33' ' ' ILE . 96.0 Cg_endo -77.9 150.62 27.05 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.649 2.899 . . . . 0.0 110.408 178.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -54.37 -29.99 50.39 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -63.36 -19.96 65.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.264 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -97.69 -14.05 21.12 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.417 0.553 . . . . 0.0 111.749 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.62 119.84 25.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -77.24 -61.49 1.97 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.394 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.56 173.74 15.06 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.074 0.95 . . . . 0.0 110.809 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.496 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -63.21 163.47 10.24 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.7 1.2 . . . . 0.0 111.452 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -134.1 -53.19 0.85 Allowed 'General case' 0 CA--C 1.518 -0.261 0 O-C-N 121.075 -1.016 . . . . 0.0 109.241 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -144.68 132.33 16.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -108.46 92.65 4.14 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.541 1.162 . . . . 0.0 109.569 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -132.09 156.49 46.23 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 128.345 2.658 . . . . 0.0 105.738 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -134.94 118.3 16.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.494 1.918 . . . . 0.0 108.281 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.607 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -146.71 137.62 24.04 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -134.63 145.58 48.74 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.641 1.977 . . . . 0.0 107.839 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -151.54 170.29 20.01 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 107.302 179.325 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.443 ' O ' HD13 ' A' ' 58' ' ' LEU . 39.5 mt -127.5 128.79 70.17 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.154 0 C-N-CA 123.316 0.646 . . . . 0.0 109.329 -177.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.78 137.09 51.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 125.464 1.506 . . . . 0.0 110.554 -178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.88 117.04 23.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 129.284 3.034 . . . . 0.0 111.784 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 70.3 mtp -68.2 -14.49 63.02 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.683 -1.261 . . . . 0.0 112.247 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -69.74 -53.32 18.96 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.827 -1.17 . . . . 0.0 111.53 178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.8 m -122.79 10.53 9.6 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 58.95 21.08 8.82 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.178 1.391 . . . . 0.0 112.873 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 mtmm -96.81 161.73 13.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 123.742 0.817 . . . . 0.0 110.59 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.5 mm? -82.95 153.61 24.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.1 mt -135.18 160.93 36.8 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.696 1.198 . . . . 0.0 110.437 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -78.84 -25.8 44.11 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.04 0.536 . . . . 0.0 110.4 177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.27 158.66 43.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.505 1.122 . . . . 0.0 108.906 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.09 116.5 27.41 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.78 173.84 9.18 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -63.23 -18.59 63.7 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.137 -0.977 . . . . 0.0 112.238 177.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -103.6 18.18 22.45 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.458 1.503 . . . . 0.0 109.758 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.34 158.57 33.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.246 1.818 . . . . 0.0 108.609 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.0 t -133.31 145.58 33.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 125.068 1.347 . . . . 0.0 107.572 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -93.7 137.23 33.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.66 136.25 49.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 t -107.58 103.35 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 102.998 -2.964 . . . . 0.0 102.998 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.402 ' CD2' HD11 ' A' ' 49' ' ' LEU . 2.8 mm? -95.9 92.19 6.39 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 -166.06 0.89 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 51.67 67.49 0.95 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 122.557 1.17 . . . . 0.0 112.314 176.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.83 134.35 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.984 -1.073 . . . . 0.0 109.957 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 40.9 m-85 -135.16 169.86 16.8 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.735 2.014 . . . . 0.0 110.452 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -112.93 159.79 18.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.144 2.178 . . . . 0.0 109.866 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.76 169.56 9.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.218 1.407 . . . . 0.0 110.593 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -25.36 63.49 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.44 0.696 . . . . 0.0 112.011 179.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -98.8 15.15 26.32 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.09 -1.006 . . . . 0.0 112.338 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp 71.69 2.32 4.24 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.969 1.708 . . . . 0.0 112.617 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.7 m -70.28 159.36 34.2 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -114.04 156.66 23.71 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.26 -0.9 . . . . 0.0 111.046 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -143.77 170.96 14.89 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.158 0.983 . . . . 0.0 110.088 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.5 ttm -134.59 137.37 43.68 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 126.618 1.967 . . . . 0.0 108.982 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.86 124.11 6.38 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 126.194 1.854 . . . . 0.0 109.98 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.5 mt -144.18 120.87 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 53.1 45.5 28.58 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.545 0.738 . . . . 0.0 110.843 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.6 t0 60.33 17.65 7.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.52 1.928 . . . . 0.0 113.995 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.1 137.48 54.91 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 126.27 1.828 . . . . 0.0 108.269 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.58 116.99 29.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 122.488 0.315 . . . . 0.0 110.773 -178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -106.19 125.78 51.42 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.288 1.435 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -62.66 145.35 54.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.713 0.805 . . . . 0.0 110.75 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.76 133.01 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 106.079 -1.823 . . . . 0.0 106.079 179.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.407 HD23 HG21 ' A' ' 29' ' ' THR . 4.4 mm? -124.99 156.57 69.03 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.557 1.143 . . . . 0.0 109.777 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.08 141.64 33.09 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 N-CA-C 107.301 -1.846 . . . . 0.0 107.301 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -58.96 -13.75 7.31 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.7 t -68.8 -16.35 63.77 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.65 -6.2 54.87 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 119.638 1.108 . . . . 0.0 113.473 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -56.03 157.69 4.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.886 0.851 . . . . 0.0 109.719 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.93 -23.5 35.75 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 108.353 -1.899 . . . . 0.0 108.353 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.95 -7.35 13.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.004 2.121 . . . . 0.0 109.393 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 p -156.98 158.01 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 129.083 2.953 . . . . 0.0 105.242 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -135.6 170.66 15.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.979 1.712 . . . . 0.0 106.732 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.1 162.74 11.14 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.541 0.686 . . . . 0.0 110.979 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.643 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.17 163.2 3.87 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.498 -179.223 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.643 ' N ' HD12 ' A' ' 105' ' ' LEU . 40.9 mtm180 -116.48 139.14 50.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 124.289 1.036 . . . . 0.0 111.684 -177.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.51 -19.62 62.17 Favored 'General case' 0 C--O 1.22 -0.464 0 O-C-N 123.963 0.789 . . . . 0.0 110.797 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.2 -2.88 2.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.417 1.887 . . . . 0.0 113.158 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -93.71 0.57 56.47 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.039 -1.038 . . . . 0.0 110.003 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 125.049 1.339 . . . . 0.0 110.906 -178.046 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? . . . . . 0 C--O 1.237 0.439 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -81.23 138.17 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 124.523 1.129 . . . . 0.0 108.213 -178.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -106.6 133.32 51.46 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -102.55 161.12 13.97 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -66.31 -32.89 74.56 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 64.93 137.85 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 128.627 2.771 . . . . 0.0 112.851 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.34 28.83 44.64 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 t -139.97 178.35 7.32 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.106 2.162 . . . . 0.0 110.923 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.59 -169.49 0.7 Allowed 'General case' 0 C--O 1.246 0.89 1 C-N-CA 132.02 4.128 . . . . 0.0 107.867 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.9 p -80.61 118.84 22.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 116.956 -1.897 . . . . 0.0 108.682 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -169.13 144.95 3.31 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 130.677 3.591 . . . . 0.0 105.676 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.4 p90 -165.49 177.86 7.15 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.555 1.142 . . . . 0.0 108.926 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.9 mt -133.86 125.76 49.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -139.06 140.74 38.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.371 1.468 . . . . 0.0 108.564 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t0 48.52 40.88 16.11 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.243 2.217 . . . . 0.0 113.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.9 m120 67.77 22.96 8.7 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 127.797 2.439 . . . . 0.0 114.042 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 mtpp -130.55 152.8 49.53 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.166 0.986 . . . . 0.0 109.185 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.2 t -79.19 143.39 35.44 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.3 m-85 -147.19 161.08 41.64 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 122.727 0.411 . . . . 0.0 111.248 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.462 ' CE2' HG22 ' A' ' 29' ' ' THR . 47.0 p90 -148.7 159.6 43.96 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.583 0.753 . . . . 0.0 109.453 178.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.0 t -92.49 127.79 44.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.462 HG22 ' CE2' ' A' ' 27' ' ' PHE . 1.1 p -99.47 171.98 7.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.004 0.906 . . . . 0.0 110.91 -178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -76.36 -5.69 48.29 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 127.11 2.164 . . . . 0.0 113.1 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -81.46 104.14 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 124.327 1.051 . . . . 0.0 109.614 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -92.03 140.85 29.24 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -117.13 135.47 23.1 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.83 152.6 68.97 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.097 2.531 . . . . 0.0 111.205 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.37 -26.08 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 122.008 -0.432 . . . . 0.0 110.992 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -66.58 -19.5 65.79 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.59 -0.694 . . . . 0.0 112.044 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -96.55 -14.77 22.02 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.066 1.746 . . . . 0.0 111.028 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.3 t -67.5 139.11 21.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -88.06 -54.18 4.35 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.151 1.38 . . . . 0.0 110.807 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.6 p-10 -171.06 169.33 6.61 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.314 1.446 . . . . 0.0 110.892 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.6 p -65.55 161.09 20.96 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.274 1.83 . . . . 0.0 109.466 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -130.62 -56.05 1.07 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.573 -1.203 . . . . 0.0 112.306 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.9 t -148.79 143.73 18.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 119.194 0.906 . . . . 0.0 111.444 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -121.96 109.28 14.41 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.967 1.307 . . . . 0.0 109.82 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -136.81 156.69 48.17 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 130.853 3.661 . . . . 0.0 105.723 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -117.7 114.94 24.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.576 1.08 . . . . 0.0 109.941 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.576 ' HE3' HD23 ' A' ' 49' ' ' LEU . 9.3 tptm -147.02 122.58 10.44 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.073 0.949 . . . . 0.0 109.556 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.416 HD12 HG22 ' A' ' 70' ' ' VAL . 9.7 tt -135.76 141.34 44.81 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.943 2.097 . . . . 0.0 107.578 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.61 HD22 HD11 ' A' ' 58' ' ' LEU . 0.8 OUTLIER -151.61 171.31 17.82 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.682 1.193 . . . . 0.0 109.725 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.2 mt -123.98 130.52 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.7 t -125.88 151.92 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.511 1.525 . . . . 0.0 107.238 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -101.52 126.58 48.35 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.2 1.364 . . . . 0.0 108.321 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.8 mtp -64.91 -21.19 66.77 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.793 1.633 . . . . 0.0 112.323 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -54.56 38.96 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 119.052 0.842 . . . . 0.0 112.795 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.2 m -112.62 -2.51 14.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.755 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 59.5 34.61 22.57 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.468 1.907 . . . . 0.0 111.162 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -111.82 156.75 21.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.494 0.717 . . . . 0.0 110.464 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.61 HD11 HD22 ' A' ' 49' ' ' LEU . 3.6 mm? -67.53 142.45 56.54 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.087 . . . . 0.0 110.12 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.3 mt -120.7 175.72 5.88 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.142 1.777 . . . . 0.0 110.787 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.2 m -116.2 3.67 13.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.586 2.355 . . . . 0.0 111.019 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.1 t -160.16 160.79 33.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 p -97.68 121.18 39.28 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.346 1.459 . . . . 0.0 107.679 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.65 168.29 15.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.382 1.073 . . . . 0.0 110.607 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -50.74 -41.84 56.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -77.74 -1.68 32.47 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.769 0.713 . . . . 0.0 111.535 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.6 t -112.77 163.5 14.51 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.804 1.642 . . . . 0.0 110.831 -178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.32 134.26 17.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 129.315 3.046 . . . . 0.0 104.935 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.49 144.23 28.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -127.24 145.44 50.78 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.416 HG22 HD12 ' A' ' 48' ' ' LEU . 7.7 t -120.43 104.14 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 103.141 -2.911 . . . . 0.0 103.141 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -98.23 93.76 6.41 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -169.17 -167.48 0.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 t30 49.89 67.98 0.82 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.836 1.654 . . . . 0.0 113.123 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.6 mt -71.47 144.42 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.353 1.461 . . . . 0.0 111.952 -178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -137.36 169.46 17.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.373 2.669 . . . . 0.0 110.102 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -121.48 154.65 36.32 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 126.414 1.886 . . . . 0.0 108.136 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.88 166.97 10.51 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 125.753 1.621 . . . . 0.0 109.978 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m -62.17 -27.56 69.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.415 0.286 . . . . 0.0 111.054 178.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -84.35 15.42 3.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.834 1.254 . . . . 0.0 110.471 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.9 mmmm 66.57 4.44 3.34 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.9 1.68 . . . . 0.0 111.056 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.01 164.65 26.38 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 178.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.0 mt -116.66 155.22 29.19 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 109.145 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.3 p -147.81 166.75 26.63 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.89 0.476 . . . . 0.0 110.039 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 50.5 ttm -130.86 141.95 50.35 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 126.077 1.751 . . . . 0.0 110.249 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.27 121.82 5.66 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 125.49 1.519 . . . . 0.0 110.483 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.2 mt -140.77 116.72 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 104.451 -2.426 . . . . 0.0 104.451 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 53.44 51.13 15.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.81 0.844 . . . . 0.0 110.628 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 62.4 -2.89 0.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.389 2.676 . . . . 0.0 115.769 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -101.98 138.35 39.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.368 1.867 . . . . 0.0 108.581 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -96.21 116.48 29.07 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -105.8 127.86 53.36 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.873 1.669 . . . . 0.0 109.33 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.415 ' HB2' HD13 ' A' ' 33' ' ' ILE . 23.3 ttpt -63.41 150.73 42.89 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.994 0.918 . . . . 0.0 110.152 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -119.3 133.68 65.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 179.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -126.07 161.24 52.82 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.388 1.075 . . . . 0.0 110.03 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.45 153.83 65.46 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.864 2.376 . . . . 0.0 109.611 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.2 pm0 -56.56 -22.83 36.1 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.491 0.716 . . . . 0.0 110.819 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.6 m -57.17 -22.65 41.93 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.903 1.681 . . . . 0.0 111.19 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -76.31 1.1 17.09 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.731 1.212 . . . . 0.0 113.2 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.75 143.21 37.54 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 120.968 -1.083 . . . . 0.0 110.61 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.82 -42.44 1.9 Allowed Glycine 0 CA--C 1.522 0.508 0 C-N-CA 125.806 1.669 . . . . 0.0 110.737 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.65 -16.1 13.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.587 1.193 . . . . 0.0 111.771 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.51 143.47 41.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -135.15 169.61 17.18 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.465 1.106 . . . . 0.0 108.929 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.9 158.37 30.83 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.509 0.671 . . . . 0.0 109.602 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.19 164.12 13.83 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.489 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -113.24 135.78 53.45 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.362 1.065 . . . . 0.0 110.032 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.539 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.7 OUTLIER -65.43 -10.64 35.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.971 1.709 . . . . 0.0 111.386 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -60.29 -25.36 65.68 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.696 1.599 . . . . 0.0 111.47 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -72.79 -0.23 12.77 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.397 -177.914 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? . . . . . 0 C--O 1.235 0.301 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.61 153.49 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -120.69 122.02 39.54 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 102.865 -3.013 . . . . 0.0 102.865 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -105.71 -178.03 3.53 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 120.822 1.646 . . . . 0.0 112.633 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -56.95 -33.95 67.53 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 129.153 2.981 . . . . 0.0 115.15 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 38.34 70.71 0.19 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 127.911 2.484 . . . . 0.0 114.28 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.0 7.97 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 113.6 -1.636 . . . . 0.0 111.981 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 179.26 6.57 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.021 0.928 . . . . 0.0 110.533 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.1 -169.62 0.64 Allowed 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.9 p -78.29 122.07 25.25 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 119.467 -2.021 . . . . 0.0 110.559 -174.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -166.27 147.03 6.4 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 130.479 3.512 . . . . 0.0 105.938 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 36.5 p90 -167.0 172.76 9.88 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 125.439 1.495 . . . . 0.0 107.917 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.2 mt -134.95 121.94 35.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 O-C-N 120.537 -1.352 . . . . 0.0 108.669 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -132.62 137.36 46.99 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.136 1.374 . . . . 0.0 107.83 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.45 34.13 17.55 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.149 1.38 . . . . 0.0 112.915 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 71.52 9.79 6.44 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.131 2.572 . . . . 0.0 113.277 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -111.04 139.17 46.63 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 134.04 38.71 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.5 m-85 -137.28 166.63 23.33 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 125.037 1.335 . . . . 0.0 110.354 -178.355 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -149.21 170.47 18.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.3 t -105.04 123.42 59.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 p -92.81 169.51 10.41 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.91 1.684 . . . . 0.0 110.503 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -79.2 -10.16 59.75 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.258 1.423 . . . . 0.0 111.978 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.74 100.15 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.826 0.851 . . . . 0.0 109.039 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -86.49 147.21 26.08 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.76 137.43 24.31 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.99 1.316 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.83 147.47 75.04 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.729 2.286 . . . . 0.0 109.326 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -55.78 -32.96 63.93 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.387 0.675 . . . . 0.0 112.728 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -64.9 -21.88 66.89 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.954 0.901 . . . . 0.0 112.075 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -90.98 -19.76 22.87 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.489 -0.757 . . . . 0.0 110.432 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.9 t -70.3 129.55 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -83.12 -61.58 1.82 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.74 0.816 . . . . 0.0 110.529 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -161.12 169.67 21.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.483 0.583 . . . . 0.0 110.763 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.7 p -64.77 153.03 41.11 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.026 0.93 . . . . 0.0 109.327 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.589 ' HE3' HD12 ' A' ' 82' ' ' LEU . 8.6 ttmm -124.66 -50.36 1.74 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.2 t -149.71 140.69 16.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -106.84 121.08 43.68 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.802 1.241 . . . . 0.0 108.073 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -150.3 159.03 44.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.423 3.489 . . . . 0.0 105.85 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.45 107.39 5.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -138.36 129.8 27.6 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.5 tt -137.84 138.41 39.1 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.17 169.3 18.14 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 125.284 1.433 . . . . 0.0 107.343 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 65.7 mt -124.43 131.21 73.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.3 t -122.25 127.62 75.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 124.865 1.266 . . . . 0.0 110.837 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HB2' HD21 ' A' ' 59' ' ' LEU . 38.2 t70 -74.63 100.16 3.86 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 126.794 2.038 . . . . 0.0 107.482 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 73.1 mtp -55.22 -29.14 57.38 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.488 0.585 . . . . 0.0 112.157 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.64 84.67 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 125.03 1.332 . . . . 0.0 113.556 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -121.85 -4.63 9.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.955 1.252 . . . . 0.0 112.216 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 63.26 34.57 13.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.769 2.028 . . . . 0.0 110.291 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -119.83 157.14 29.28 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.095 0.958 . . . . 0.0 110.937 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.44 151.41 44.02 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.022 0.529 . . . . 0.0 111.648 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 52' ' ' ASP . 46.4 mt -134.84 174.49 10.53 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.726 2.01 . . . . 0.0 109.07 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 21.0 p -117.16 -5.31 11.37 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.707 1.603 . . . . 0.0 112.705 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 m -144.88 129.97 18.5 Favored 'General case' 0 CA--C 1.521 -0.166 0 O-C-N 120.001 -1.687 . . . . 0.0 107.7 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.59 122.48 23.99 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -127.77 170.7 12.46 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.937 2.095 . . . . 0.0 108.349 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -58.63 -13.13 5.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 -177.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -104.9 8.64 34.71 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.827 1.194 . . . . 0.0 109.325 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.21 162.03 27.12 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.441 1.097 . . . . 0.0 112.793 -177.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -132.31 160.04 42.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 126.363 1.865 . . . . 0.0 108.251 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 t -105.72 142.7 34.99 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -134.24 120.46 20.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.49 103.22 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -91.85 93.01 8.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -162.05 -169.22 2.12 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 t30 48.12 67.4 0.84 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.848 2.059 . . . . 0.0 113.183 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.8 mt -73.59 146.81 9.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 O-C-N 121.057 -1.027 . . . . 0.0 111.064 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -142.75 169.47 17.51 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 126.674 1.989 . . . . 0.0 111.191 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -114.53 158.11 22.09 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 127.307 2.243 . . . . 0.0 106.103 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.58 167.41 14.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.597 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.5 t -62.99 -23.5 67.47 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 122.979 0.512 . . . . 0.0 111.481 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -86.7 6.63 30.33 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 120.805 -1.185 . . . . 0.0 109.47 179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm 68.89 1.18 3.02 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.976 2.51 . . . . 0.0 111.056 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.5 m -73.81 154.97 39.3 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.589 HD12 ' HE3' ' A' ' 42' ' ' LYS . 1.2 mm? -108.71 152.88 24.23 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.161 0.984 . . . . 0.0 110.341 -178.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.6 p -141.2 177.38 8.12 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.088 0.47 . . . . 0.0 111.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.9 ttm -136.69 138.23 40.83 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 126.234 1.814 . . . . 0.0 109.398 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.65 118.44 4.67 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 107.522 -2.231 . . . . 0.0 107.522 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -135.03 123.35 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.6 m120 49.95 45.13 25.38 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 123.789 0.681 . . . . 0.0 109.878 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 63.15 18.99 11.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.528 1.931 . . . . 0.0 114.836 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -124.46 144.78 49.89 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.173 0.989 . . . . 0.0 109.844 178.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -94.15 115.99 28.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.735 0.698 . . . . 0.0 112.047 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.81 124.07 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.205 1.402 . . . . 0.0 109.764 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -62.28 147.94 46.49 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.54 1.136 . . . . 0.0 111.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -115.95 134.33 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 123.887 0.875 . . . . 0.0 109.238 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -127.6 158.46 69.91 Favored Pre-proline 0 C--O 1.235 0.313 0 C-N-CA 124.671 1.189 . . . . 0.0 109.983 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -75.39 154.3 40.6 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.718 2.279 . . . . 0.0 110.811 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.94 -6.48 12.62 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.957 -0.465 . . . . 0.0 111.811 178.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.3 p -72.86 -14.55 61.52 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.488 -1.382 . . . . 0.0 110.451 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.21 -4.92 58.02 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 142.51 34.08 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.01 0.924 . . . . 0.0 111.208 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.53 -15.24 19.99 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 126.107 1.813 . . . . 0.0 111.079 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.43 -12.68 0.8 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.473 1.509 . . . . 0.0 111.95 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.1 150.24 31.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -141.57 162.74 34.74 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.103 1.361 . . . . 0.0 108.368 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.31 167.02 1.47 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.572 0.701 . . . . 0.0 112.884 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.16 161.25 13.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.693 0.759 . . . . 0.0 112.559 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.0 mmm-85 -109.24 117.26 33.65 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -6.02 16.77 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.369 0.418 . . . . 0.0 111.795 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -59.52 -23.49 62.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 110.491 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -69.14 -12.09 61.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.728 0.811 . . . . 0.0 112.554 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.943 1.697 . . . . 0.0 107.746 -178.526 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.468 0.442 0 CA-C-O 121.414 0.626 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.2 t -95.06 133.17 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 125.627 1.571 . . . . 0.0 107.997 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -95.52 122.16 37.97 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -89.38 161.56 16.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -68.98 -33.78 74.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.827 1.651 . . . . 0.0 111.602 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 46.68 99.18 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 127.291 2.236 . . . . 0.0 114.802 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.74 20.75 53.12 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.039 -1.437 . . . . 0.0 112.395 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.91 179.53 6.12 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.75 1.62 . . . . 0.0 111.661 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -169.94 0.98 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.056 2.142 . . . . 0.0 107.361 177.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.0 p -80.63 120.4 24.52 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 124.586 2.136 . . . . 0.0 111.681 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -168.58 153.54 6.24 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 130.941 3.696 . . . . 0.0 106.108 177.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -168.52 173.79 7.26 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.0 mt -132.92 120.19 40.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -130.58 138.13 50.0 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t0 55.57 35.22 24.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.601 1.56 . . . . 0.0 112.071 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 65.1 15.65 10.12 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 127.345 2.258 . . . . 0.0 112.842 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -118.66 142.1 47.98 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.9 m -75.63 142.83 42.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -139.8 162.57 34.82 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.076 1.751 . . . . 0.0 109.585 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -148.86 166.81 27.42 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.675 1.19 . . . . 0.0 109.129 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.1 t -97.33 128.64 48.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 C-N-CA 123.04 0.536 . . . . 0.0 109.599 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 HD23 ' A' ' 94' ' ' LEU . 27.0 p -97.0 170.25 9.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.129 0.972 . . . . 0.0 111.112 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -77.82 -14.43 59.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.962 1.305 . . . . 0.0 111.982 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -69.01 101.21 1.35 Allowed 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 125.264 1.426 . . . . 0.0 110.614 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.404 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.0 tt0 -90.14 141.6 28.53 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.421 HG23 ' HD2' ' A' ' 34' ' ' PRO . 1.7 mp -118.14 143.98 33.95 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.482 1.113 . . . . 0.0 108.389 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 33' ' ' ILE . 74.5 Cg_endo -71.78 154.93 58.9 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.304 3.336 . . . . 0.0 113.383 -178.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -58.22 -33.34 69.21 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.124 0.97 . . . . 0.0 111.9 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -62.52 -23.16 66.8 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.748 0.819 . . . . 0.0 111.539 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.49 -22.84 21.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.184 0.594 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.98 119.3 6.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -77.5 -59.96 2.56 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.082 0.953 . . . . 0.0 110.223 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.37 20.11 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.511 0.725 . . . . 0.0 110.533 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.406 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -65.38 165.33 12.04 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.031 0.92 . . . . 0.0 108.724 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.89 -53.37 1.42 Allowed 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 120.785 -1.197 . . . . 0.0 108.631 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 t -140.86 145.4 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm -124.81 92.95 3.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.665 1.186 . . . . 0.0 108.566 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -137.32 155.31 49.59 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 128.962 2.905 . . . . 0.0 106.851 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -120.96 130.49 53.86 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.856 0.862 . . . . 0.0 111.844 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -148.81 126.85 11.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.403 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.4 tt -131.25 145.06 51.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.179 2.592 . . . . 0.0 110.256 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.467 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -152.3 171.04 18.6 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.588 1.955 . . . . 0.0 109.506 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.4 mt -128.34 127.77 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.187 1.395 . . . . 0.0 108.096 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 t -122.68 148.8 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.43 1.492 . . . . 0.0 109.131 -179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' A' ' 59' ' ' LEU . 4.8 t0 -92.83 125.98 37.7 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.185 1.394 . . . . 0.0 107.468 178.348 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 75.6 mtp -67.87 -26.23 65.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.869 1.213 . . . . 0.0 110.605 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -63.04 -41.55 99.52 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.4 m -121.99 -1.61 9.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.588 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 60.98 27.28 17.17 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.953 1.301 . . . . 0.0 109.835 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 9.3 mmpt? -103.45 154.03 19.88 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.391 1.076 . . . . 0.0 110.84 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.403 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -69.65 155.11 41.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 52' ' ' ASP . 89.6 mt -131.32 175.12 9.4 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.164 1.386 . . . . 0.0 109.726 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -113.94 -4.81 13.21 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.315 1.446 . . . . 0.0 110.68 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.6 p -152.41 154.06 34.82 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 120.393 1.452 . . . . 0.0 108.98 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -84.59 124.44 31.44 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -129.07 165.58 20.94 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.662 1.585 . . . . 0.0 108.392 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -56.08 -43.72 78.29 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.429 -0.794 . . . . 0.0 112.359 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -74.61 5.74 4.53 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.6 t -113.58 166.25 11.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.324 1.45 . . . . 0.0 111.034 -179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.8 t -143.48 123.8 9.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 126.704 2.002 . . . . 0.0 106.358 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.8 t -80.51 144.32 32.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.39 147.26 52.55 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.78 103.5 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -99.05 91.76 5.17 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -166.97 0.96 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -176.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 55.79 67.09 1.06 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.676 0.391 . . . . 0.0 111.716 176.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mt -77.36 138.16 20.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.569 0.747 . . . . 0.0 110.632 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.406 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.7 m-85 -137.45 169.65 17.42 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 127.175 2.19 . . . . 0.0 109.808 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -118.17 156.76 28.17 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.125 1.77 . . . . 0.0 108.283 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.01 171.05 7.77 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 126.031 1.732 . . . . 0.0 112.375 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.2 p -57.07 -37.0 71.22 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 127.309 2.244 . . . . 0.0 112.176 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -87.72 16.13 6.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.532 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 69.38 -1.34 2.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 126.821 2.049 . . . . 0.0 111.134 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.67 164.89 20.55 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.86 0.755 . . . . 0.0 109.614 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.09 144.9 41.84 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.829 1.252 . . . . 0.0 109.415 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.37 168.25 20.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.869 0.868 . . . . 0.0 109.52 178.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 38.4 ttm -134.07 143.24 47.91 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.948 1.699 . . . . 0.0 109.749 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.85 124.43 6.85 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 125.217 1.389 . . . . 0.0 110.43 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 57.0 mt -143.13 120.92 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 53.8 44.81 29.03 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.293 1.044 . . . . 0.0 109.607 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.13 14.6 3.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.706 2.802 . . . . 0.0 114.327 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -116.86 147.48 42.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.722 1.609 . . . . 0.0 107.198 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -98.9 116.52 31.33 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.931 0.892 . . . . 0.0 112.527 -177.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -108.49 128.26 54.65 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.683 1.593 . . . . 0.0 109.781 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.697 ' HE2' HD21 ' A' ' 94' ' ' LEU . 7.3 ttpt -65.75 151.0 47.6 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.413 -0.804 . . . . 0.0 110.164 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.56 134.29 63.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.697 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.3 mm? -122.32 157.91 57.29 Favored Pre-proline 0 C--O 1.233 0.237 0 C-N-CA 124.023 0.929 . . . . 0.0 110.119 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.59 155.71 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.377 2.052 . . . . 0.0 110.346 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.64 -9.2 25.08 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.375 -0.828 . . . . 0.0 110.557 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 m -70.82 -8.1 50.1 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.279 2.232 . . . . 0.0 110.72 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . 0.257 0.0 OUTLIER -114.49 3.15 14.83 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -51.28 161.09 0.47 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.866 1.266 . . . . 0.0 111.784 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.33 -42.54 3.11 Favored Glycine 0 CA--C 1.522 0.519 0 O-C-N 120.926 -1.109 . . . . 0.0 111.351 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.96 53.18 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.124 1.462 . . . . 0.0 108.983 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.5 147.94 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 C-N-CA 126.443 1.897 . . . . 0.0 108.622 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -114.15 167.44 10.68 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.027 1.331 . . . . 0.0 108.508 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.88 166.08 20.24 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.851 0.834 . . . . 0.0 109.317 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -61.41 157.95 15.71 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.351 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.473 ' N ' HD12 ' A' ' 105' ' ' LEU . 41.0 ptt180 -110.45 139.46 45.65 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.005 0.922 . . . . 0.0 113.27 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.2 -28.15 69.18 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.976 1.71 . . . . 0.0 110.105 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -53.22 -30.31 37.23 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.006 1.722 . . . . 0.0 113.792 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -70.08 -11.29 60.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.432 0.693 . . . . 0.0 109.661 -177.22 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.674 -0.679 . . . . 0.0 109.735 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.7 t -71.19 145.49 12.52 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 CA-C-N 119.193 0.906 . . . . 0.0 109.224 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 -103.14 97.35 7.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.5 145.0 41.72 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.24 -25.44 63.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.701 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 66.78 142.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.671 2.389 . . . . 0.0 112.901 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.99 28.03 15.89 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.249 0.928 . . . . 0.0 112.928 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -137.28 177.89 7.51 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 125.305 1.442 . . . . 0.0 110.931 -178.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -74.79 -168.9 0.79 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 127.173 2.189 . . . . 0.0 107.701 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.251 7.7 p -79.61 120.21 23.63 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 120.43 -1.419 . . . . 0.0 107.248 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -168.18 148.21 4.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 131.649 3.98 . . . . 0.0 104.712 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -172.68 165.57 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 mm -117.87 135.9 56.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 122.027 0.918 . . . . 0.0 108.642 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -149.09 142.74 25.48 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.221 -1.809 . . . . 0.0 108.962 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t0 51.85 33.61 11.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.871 1.268 . . . . 0.0 110.863 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 55.57 29.12 12.9 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 127.573 2.349 . . . . 0.0 112.463 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -124.6 144.01 50.4 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 m -81.88 114.43 20.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -117.76 165.7 13.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.722 2.009 . . . . 0.0 111.879 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -150.33 173.89 13.48 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.175 1.39 . . . . 0.0 109.576 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.49 128.55 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 p -90.02 163.88 14.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.943 1.297 . . . . 0.0 113.584 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -75.74 -16.78 60.09 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.221 1.809 . . . . 0.0 112.737 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -75.18 136.94 41.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.602 1.561 . . . . 0.0 106.893 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.515 ' C ' HD12 ' A' ' 33' ' ' ILE . 42.3 tt0 -118.9 147.32 44.12 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.708 1.603 . . . . 0.0 111.095 -178.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.515 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.5 mp -118.46 136.88 24.24 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.605 1.562 . . . . 0.0 107.432 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.02 156.87 26.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 124.615 3.543 . . . . 0.0 112.136 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -57.95 -28.47 64.35 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.811 0.844 . . . . 0.0 111.737 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -67.13 -14.42 62.89 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.07 -1.019 . . . . 0.0 112.119 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -104.08 -8.31 19.6 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.609 1.164 . . . . 0.0 110.889 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.65 132.38 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.703 1.601 . . . . 0.0 108.668 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.63 -56.09 3.92 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.572 1.149 . . . . 0.0 110.445 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -169.08 170.09 9.04 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.713 1.605 . . . . 0.0 109.412 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.8 p -68.97 174.03 4.86 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.7 tttp -138.92 -39.02 0.5 Allowed 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.179 -0.951 . . . . 0.0 112.407 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -149.34 117.55 0.93 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.714 0.806 . . . . 0.0 109.043 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 124.22 33.48 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 104.322 -2.473 . . . . 0.0 104.322 176.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.69 157.18 42.66 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 128.417 2.687 . . . . 0.0 105.312 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -140.59 109.7 6.14 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.413 1.085 . . . . 0.0 110.332 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -144.18 139.72 28.92 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -137.28 144.74 42.84 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 127.696 2.398 . . . . 0.0 108.256 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -154.47 169.55 23.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 61.9 mt -131.07 134.02 62.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 t -122.88 143.11 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.468 1.107 . . . . 0.0 108.282 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.08 123.86 28.74 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 106.388 -1.708 . . . . 0.0 106.388 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtp -68.24 -21.85 64.81 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 120.287 1.403 . . . . 0.0 114.018 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -74.27 -53.57 9.48 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.856 0.753 . . . . 0.0 110.364 -179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.8 m -91.92 -15.87 27.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.54 30.76 19.99 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 126.545 1.938 . . . . 0.0 111.798 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -115.59 161.09 19.13 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.633 1.173 . . . . 0.0 109.257 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.34 149.45 44.39 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.193 0.52 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 mt -129.19 173.05 10.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.33 1.852 . . . . 0.0 107.786 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 t -118.66 12.72 13.16 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.255 1.022 . . . . 0.0 111.512 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.5 p -159.07 157.75 31.7 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.827 1.194 . . . . 0.0 109.28 -179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 t -89.7 119.91 30.51 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.948 0.899 . . . . 0.0 110.098 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -130.72 160.12 35.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.314 1.045 . . . . 0.0 109.473 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -51.8 -20.72 2.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -104.32 5.71 34.73 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.807 1.639 . . . . 0.0 111.161 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 21.1 m -115.55 165.74 12.67 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 124.95 1.3 . . . . 0.0 111.203 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.8 t -140.57 144.5 27.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 124.515 1.126 . . . . 0.0 108.259 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.1 t -87.48 143.37 27.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.761 1.224 . . . . 0.0 108.89 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.0 mt -136.78 122.88 20.34 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.9 t -104.88 103.29 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 103.556 -2.757 . . . . 0.0 103.556 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.02 97.48 10.74 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -166.94 -172.92 2.2 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 44.22 68.96 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.939 1.696 . . . . 0.0 114.79 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.8 mt -71.03 141.14 17.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.73 1.612 . . . . 0.0 109.223 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -131.44 169.43 16.06 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.171 1.788 . . . . 0.0 109.341 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -114.85 152.79 31.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.207 1.403 . . . . 0.0 107.546 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.09 160.74 14.59 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.947 1.299 . . . . 0.0 109.824 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -65.07 -24.68 67.53 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.238 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -85.7 12.85 8.04 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 126.588 1.955 . . . . 0.0 110.662 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 69.75 -1.82 2.19 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.917 2.087 . . . . 0.0 110.524 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.0 m -70.97 168.69 16.45 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.4 148.8 45.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.909 0.884 . . . . 0.0 111.177 -178.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 21.1 p -141.94 172.06 13.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.151 0.98 . . . . 0.0 111.019 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.4 ttm -133.05 139.71 47.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 126.121 1.768 . . . . 0.0 109.365 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.59 124.3 6.64 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.5 mt -141.98 123.03 12.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 49.27 44.89 23.61 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.573 1.149 . . . . 0.0 110.871 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.6 t0 67.11 4.27 3.54 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.961 2.905 . . . . 0.0 116.142 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -111.81 145.89 38.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.903 1.281 . . . . 0.0 108.907 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -98.86 117.91 34.43 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 123.034 0.534 . . . . 0.0 111.656 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -105.95 132.15 52.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.685 1.194 . . . . 0.0 107.808 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HE2' HD21 ' A' ' 94' ' ' LEU . 1.4 ttpm? -72.1 158.54 35.75 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 118.596 -1.242 . . . . 0.0 110.336 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.63 133.56 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.625 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.5 mm? -127.04 163.51 41.18 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 125.991 1.716 . . . . 0.0 110.736 -177.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.76 143.3 26.6 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.296 1.997 . . . . 0.0 107.859 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -12.64 20.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.3 m -65.77 -13.81 60.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -76.1 -1.24 25.11 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.362 1.065 . . . . 0.0 112.382 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -50.46 149.77 2.96 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.506 1.122 . . . . 0.0 109.273 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.62 -42.33 2.91 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.45 -39.56 13.28 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.568 0.747 . . . . 0.0 108.986 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -130.44 170.79 18.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 125.798 1.639 . . . . 0.0 109.6 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -145.25 166.34 25.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.469 2.308 . . . . 0.0 108.186 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.42 174.24 5.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.445 0.641 . . . . 0.0 110.792 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.292 0.4 OUTLIER -68.99 176.17 3.3 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.134 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ptp85 -129.92 141.47 50.78 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 125.157 1.383 . . . . 0.0 112.229 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.0 mp -71.63 -17.95 62.23 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.248 0.619 . . . . 0.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -57.8 -26.53 62.08 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.082 1.753 . . . . 0.0 113.484 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -76.63 -9.43 58.66 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.772 0.829 . . . . 0.0 110.446 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 tptt . . . . . 0 N--CA 1.463 0.202 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.2 t -119.78 139.92 45.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 120.707 1.594 . . . . 0.0 108.798 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -107.18 118.41 36.65 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -84.66 175.42 9.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -80.84 -34.13 34.04 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 127.417 2.287 . . . . 0.0 110.459 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 54.13 127.64 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 128.465 2.706 . . . . 0.0 115.042 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.98 25.23 61.57 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.363 -0.836 . . . . 0.0 112.577 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 m -140.49 -179.62 6.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 126.95 2.1 . . . . 0.0 110.785 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -73.69 -171.06 0.96 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.491 1.516 . . . . 0.0 109.005 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.7 p -80.53 120.76 24.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 119.511 -1.993 . . . . 0.0 111.626 -175.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -167.16 154.9 9.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.44 3.896 . . . . 0.0 105.294 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 49.0 p90 -170.11 173.49 5.88 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.693 1.588 . . . . 0.0 107.437 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.1 mt -131.58 119.01 41.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 O-C-N 120.529 -1.357 . . . . 0.0 107.496 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -129.38 137.8 51.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.28 34.12 22.13 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.796 1.239 . . . . 0.0 111.438 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.7 m120 62.98 14.99 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.452 2.701 . . . . 0.0 112.931 -178.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -111.62 132.94 54.22 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.8 m -76.32 129.06 36.08 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.0 m-85 -132.84 164.1 27.63 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 126.603 1.961 . . . . 0.0 110.516 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -149.25 159.37 44.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 109.442 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 t -89.72 132.23 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.4 p -102.04 166.3 10.69 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.732 1.213 . . . . 0.0 110.091 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.1 -7.69 55.32 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.342 1.057 . . . . 0.0 112.122 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -71.28 114.22 9.12 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -101.99 144.11 31.01 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.07 140.01 23.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.863 2.065 . . . . 0.0 108.403 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.77 156.15 39.56 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 123.016 2.477 . . . . 0.0 109.89 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.53 -29.47 69.14 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.12 -19.5 65.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.074 0.55 . . . . 0.0 111.936 179.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -93.17 -13.57 28.24 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.592 0.757 . . . . 0.0 110.28 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 65.7 t -75.2 123.5 31.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -80.24 -61.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.44 163.99 38.79 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.253 -0.904 . . . . 0.0 112.351 -178.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 m -65.5 137.26 57.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.601 1.56 . . . . 0.0 107.152 178.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' OE2' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -112.29 -53.87 2.67 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.883 -177.928 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.1 t -141.01 134.39 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 119.814 1.188 . . . . 0.0 112.547 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.3 mtpt -103.53 110.21 22.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.05 156.75 44.1 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.445 2.698 . . . . 0.0 106.493 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -128.31 113.18 15.3 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.844 0.857 . . . . 0.0 110.723 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.88 134.41 18.63 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.954 0.797 . . . . 0.0 110.468 178.263 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.478 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 9.0 tt -138.32 145.04 40.69 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.85 1.66 . . . . 0.0 108.283 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -148.75 170.39 18.32 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.099 1.36 . . . . 0.0 107.402 179.266 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.431 ' O ' HD13 ' A' ' 58' ' ' LEU . 50.9 mt -129.48 132.21 66.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.3 t -126.72 139.74 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.649 1.18 . . . . 0.0 109.458 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -85.99 128.36 34.83 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.309 -0.87 . . . . 0.0 109.406 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 46.9 mtp -68.64 -19.44 64.42 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttm -77.16 -46.85 22.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.519 1.509 . . . . 0.0 111.952 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.0 p -105.2 -6.06 20.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 63.88 18.81 11.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.695 1.198 . . . . 0.0 110.378 -179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -101.72 159.91 14.91 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.342 0.974 . . . . 0.0 111.739 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.8 mm? -73.2 145.76 46.03 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.415 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 mt -126.6 166.32 17.53 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.893 2.077 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.83 -33.55 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.612 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.5 m -130.02 150.01 51.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.461 1.104 . . . . 0.0 109.551 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.92 111.09 17.79 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.495 0.718 . . . . 0.0 110.506 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -101.8 168.69 9.28 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 177.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -58.11 -32.66 68.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -78.53 -3.05 41.73 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.071 0.948 . . . . 0.0 110.445 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.4 t -114.58 161.66 17.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.393 1.477 . . . . 0.0 113.219 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.3 t -133.88 146.46 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 126.125 1.77 . . . . 0.0 108.431 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.29 144.19 29.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.966 1.306 . . . . 0.0 109.554 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.7 mt -135.37 122.53 21.53 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.865 -1.147 . . . . 0.0 108.162 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.443 HG22 HD12 ' A' ' 48' ' ' LEU . 3.5 t -106.71 103.41 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -99.36 96.64 7.85 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.124 -1.806 . . . . 0.0 106.124 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -170.22 -168.91 0.78 Allowed 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 50.06 68.31 0.77 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.88 1.272 . . . . 0.0 112.912 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.74 145.33 11.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.638 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -135.87 169.01 18.26 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.926 2.09 . . . . 0.0 109.064 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.424 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 tt0 -119.16 149.66 41.35 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.482 1.513 . . . . 0.0 107.071 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.56 166.58 10.64 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.593 1.557 . . . . 0.0 110.255 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.2 p -61.2 -29.95 70.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.911 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -101.58 29.47 4.85 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.995 1.718 . . . . 0.0 112.885 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 65.76 -0.82 1.19 Allowed 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.631 1.972 . . . . 0.0 114.055 178.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -67.15 158.89 30.12 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.0 mt -115.62 144.43 43.91 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -138.76 164.88 28.44 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.8 ttm -127.7 137.35 52.45 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.317 1.847 . . . . 0.0 109.524 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.44 117.94 4.52 Favored Glycine 0 CA--C 1.521 0.438 0 C-N-CA 124.71 1.148 . . . . 0.0 110.393 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.8 mt -134.83 118.79 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 125.505 1.522 . . . . 0.0 107.101 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.6 m120 49.94 47.21 23.56 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.481 1.113 . . . . 0.0 109.754 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 65.18 9.38 5.53 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.165 2.186 . . . . 0.0 114.733 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -115.48 136.95 52.56 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.164 1.386 . . . . 0.0 108.737 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -92.64 117.35 29.88 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.97 -0.456 . . . . 0.0 111.156 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 132.17 52.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.135 -0.978 . . . . 0.0 108.778 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 147.54 51.66 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -115.62 132.62 64.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -124.32 157.38 64.86 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 124.824 1.25 . . . . 0.0 108.775 -178.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.9 154.39 67.24 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.659 2.239 . . . . 0.0 109.685 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -61.04 -15.19 29.51 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.808 0.337 . . . . 0.0 111.631 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.3 p -80.05 -7.73 59.01 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 112.242 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -87.5 -9.58 54.14 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.696 1.598 . . . . 0.0 112.14 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.51 161.83 0.93 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.728 1.211 . . . . 0.0 113.492 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.78 -42.59 2.65 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 107.941 -2.064 . . . . 0.0 107.941 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.18 -27.62 22.92 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.194 0.998 . . . . 0.0 109.396 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.6 p -132.6 166.64 28.69 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.554 1.542 . . . . 0.0 109.882 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -135.94 165.19 26.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.841 2.456 . . . . 0.0 107.363 178.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.98 178.93 0.58 Allowed 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.452 0.644 . . . . 0.0 111.083 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.578 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -70.9 170.23 13.1 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.822 -0.549 . . . . 0.0 109.721 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.578 ' N ' HD12 ' A' ' 105' ' ' LEU . 88.2 mtt180 -126.02 142.18 51.63 Favored 'General case' 0 CA--C 1.52 -0.199 0 O-C-N 121.166 -0.959 . . . . 0.0 110.11 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.4 -17.24 62.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.766 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.68 -18.07 61.74 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -73.15 -13.93 61.27 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.679 0.672 . . . . 0.0 111.784 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 C--O 1.248 0.988 0 C-N-CA 126.369 1.867 . . . . 0.0 110.342 -177.543 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.4 t -116.44 160.27 15.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.039 1.335 . . . . 0.0 108.608 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -128.46 107.69 9.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 102.821 -3.029 . . . . 0.0 102.821 178.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -82.36 166.63 19.29 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -33.98 76.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.158 0.89 . . . . 0.0 110.801 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 55.66 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.606 1.962 . . . . 0.0 113.424 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.51 7.3 51.71 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.819 1.199 . . . . 0.0 112.477 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 m -131.96 179.31 6.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.112 1.765 . . . . 0.0 110.031 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -73.4 -169.74 0.7 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.118 2.167 . . . . 0.0 107.778 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.0 p -80.71 120.31 24.44 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 120.068 -1.645 . . . . 0.0 111.708 -176.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -168.82 147.12 3.99 Favored 'General case' 0 CA--C 1.54 0.573 1 C-N-CA 133.622 4.769 . . . . 0.0 103.224 177.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 44.9 p90 -165.55 169.17 15.74 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 125.311 1.444 . . . . 0.0 107.83 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 20' ' ' ILE . 2.5 mp -123.52 123.02 66.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 O-C-N 120.472 -1.393 . . . . 0.0 108.014 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -133.09 139.2 47.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t70 54.03 33.23 17.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.506 1.522 . . . . 0.0 112.626 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 65.27 24.02 12.19 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.33 1.452 . . . . 0.0 110.486 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -125.13 137.23 54.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.34 144.59 40.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.545 -2.021 . . . . 0.0 105.545 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.6 m-85 -147.99 167.45 24.88 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 127.032 2.133 . . . . 0.0 110.472 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -150.02 171.29 17.08 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.041 0.937 . . . . 0.0 108.761 177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.96 127.53 58.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -94.9 169.19 10.31 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.467 1.107 . . . . 0.0 110.472 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.24 -15.52 58.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.937 1.295 . . . . 0.0 112.817 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 111.96 6.38 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.333 0.653 . . . . 0.0 111.196 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -93.6 140.18 29.91 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.438 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.7 mp -111.67 141.32 24.43 Favored Pre-proline 0 N--CA 1.466 0.358 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.65 151.47 41.45 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.7 1.6 . . . . 0.0 111.194 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -53.97 -29.06 41.3 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.737 1.615 . . . . 0.0 113.263 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -69.89 -29.09 66.2 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 123.289 0.636 . . . . 0.0 110.864 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -84.91 -15.57 44.03 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.797 0.839 . . . . 0.0 110.666 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.32 138.8 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -92.8 -61.57 1.56 Allowed 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.34 166.49 18.61 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.086 0.857 . . . . 0.0 112.245 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.7 m -63.69 138.76 58.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.599 1.16 . . . . 0.0 109.069 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -116.27 -36.34 4.07 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -148.76 142.8 18.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -117.83 102.34 9.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -135.67 157.81 45.94 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 130.419 3.488 . . . . 0.0 106.577 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -141.45 110.45 6.21 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.103 1.361 . . . . 0.0 107.608 179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -141.1 125.53 17.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 tt -125.34 144.39 50.52 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.555 1.542 . . . . 0.0 107.749 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -153.45 169.95 21.92 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 108.948 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.571 ' O ' HD13 ' A' ' 58' ' ' LEU . 31.8 mt -124.29 138.41 53.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 125.613 1.565 . . . . 0.0 106.785 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.6 t -132.77 124.82 51.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.429 1.092 . . . . 0.0 109.977 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -62.19 121.65 13.62 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.664 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.3 mtp -68.2 -18.24 64.53 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 120.71 1.596 . . . . 0.0 112.546 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -84.18 -25.69 29.36 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -122.35 -13.43 8.06 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.273 0.629 . . . . 0.0 111.802 -178.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 63.65 21.27 12.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.605 1.562 . . . . 0.0 109.901 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -105.18 153.15 21.94 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.61 1.164 . . . . 0.0 110.783 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -67.34 148.22 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.958 0.903 . . . . 0.0 110.856 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.5 mt -136.04 177.28 7.96 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.004 1.722 . . . . 0.0 109.392 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.3 p -105.65 -30.36 9.53 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.144 1.377 . . . . 0.0 111.088 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -122.03 151.89 40.35 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.005 0.82 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -89.07 93.28 9.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.243 0.617 . . . . 0.0 109.551 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.69 164.39 18.63 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -57.33 -34.24 68.55 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -80.72 5.39 15.88 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.642 -0.661 . . . . 0.0 111.584 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.4 t -113.42 177.99 4.44 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.201 1.4 . . . . 0.0 111.634 -178.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 p -145.85 159.19 12.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 126.686 1.994 . . . . 0.0 107.419 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.23 143.14 42.46 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.0 mt -131.33 150.87 51.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 t -127.86 102.65 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -86.14 92.03 8.61 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.29 -173.02 3.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 47.3 67.63 0.77 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.874 1.67 . . . . 0.0 112.882 177.071 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mt -77.9 141.81 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 O-C-N 121.177 -0.952 . . . . 0.0 109.498 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -140.87 166.11 25.69 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.942 1.697 . . . . 0.0 110.039 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -110.9 158.04 19.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.918 2.087 . . . . 0.0 106.952 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.94 168.78 9.77 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.544 1.138 . . . . 0.0 112.27 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -58.06 -35.89 72.0 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.91 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -84.89 21.13 1.65 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.684 1.193 . . . . 0.0 111.785 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.8 mptt 59.1 19.68 7.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.306 1.443 . . . . 0.0 110.721 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.543 ' HB3' ' HE2' ' A' ' 92' ' ' LYS . 63.3 m -79.69 168.68 19.03 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mt -125.46 143.59 50.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.5 p -147.84 168.64 21.68 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.608 0.763 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.0 ttm -135.23 139.54 44.56 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.181 1.792 . . . . 0.0 109.733 -178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.1 6.98 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.9 mt -138.72 124.42 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 52.07 42.53 30.55 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.826 0.822 . . . . 0.0 109.004 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 60.44 20.86 10.52 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.834 2.054 . . . . 0.0 114.105 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 -122.07 137.66 54.73 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.712 1.605 . . . . 0.0 108.477 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -93.27 116.32 28.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -106.52 129.83 54.41 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.536 1.135 . . . . 0.0 110.754 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.543 ' HE2' ' HB3' ' A' ' 81' ' ' SER . 51.1 tttm -64.28 145.36 56.14 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.621 -0.674 . . . . 0.0 109.878 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.52 133.09 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -120.13 156.64 54.6 Favored Pre-proline 0 C--O 1.238 0.468 0 C-N-CA 124.128 0.971 . . . . 0.0 109.342 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.02 141.88 54.61 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 N-CA-C 106.726 -2.067 . . . . 0.0 106.726 179.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -22.1 37.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.673 -0.642 . . . . 0.0 111.668 -179.15 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 t -66.16 -13.17 59.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.129 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -3.16 43.56 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 120.563 1.529 . . . . 0.0 114.098 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -50.85 162.01 0.31 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.24 1.416 . . . . 0.0 113.794 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.84 -43.65 2.98 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 127.074 2.274 . . . . 0.0 110.969 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.89 -22.54 45.8 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -133.05 159.23 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 C-N-CA 130.78 3.632 . . . . 0.0 106.1 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -135.6 169.42 17.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 123.461 0.704 . . . . 0.0 109.953 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.84 160.29 17.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.71 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.527 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.2 158.6 8.72 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.937 0.875 . . . . 0.0 112.774 -178.83 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.527 ' N ' HD12 ' A' ' 105' ' ' LEU . 9.4 mtt85 -109.94 119.24 38.7 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 124.744 1.217 . . . . 0.0 108.551 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -9.35 43.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.937 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.62 -22.12 66.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.452 1.101 . . . . 0.0 110.959 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -70.24 -9.04 54.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.646 1.178 . . . . 0.0 113.356 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 125.018 1.327 . . . . 0.0 110.178 -178.078 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.884 0.373 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -154.13 109.63 3.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.888 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.99 109.02 19.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.46 75.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.845 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -179.18 121.43 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -118.06 139.14 51.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.65 127.82 33.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.1 t -80.52 133.4 29.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -103.23 111.9 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -89.61 149.74 22.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -62.62 -34.97 78.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.845 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 65.27 138.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.89 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.69 25.47 9.17 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.479 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.29 -175.91 4.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.363 . . . . 0.0 110.847 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -165.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.434 HG21 HD23 ' A' ' 105' ' ' LEU . 22.2 p -75.67 116.75 16.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.142 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -171.54 153.46 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.679 ' HZ ' HD12 ' A' ' 93' ' ' ILE . 9.8 p90 -174.9 158.1 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.886 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 84.8 mt -120.27 127.97 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -131.18 130.68 43.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t0 63.74 35.64 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.838 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 63.89 30.4 14.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.872 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -134.28 133.87 41.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -64.97 144.16 57.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.876 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 95' ' ' PRO . 5.7 m-85 -154.33 157.22 38.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 29' ' ' THR . 35.1 p90 -149.24 163.5 37.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 86' ' ' ILE . 21.7 t -88.77 127.33 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.164 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.52 HG22 ' CE2' ' A' ' 27' ' ' PHE . 19.1 p -97.78 165.19 12.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.14 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -73.04 -17.41 61.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.853 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.72 126.61 28.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.857 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.433 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.4 tt0 -110.24 140.39 44.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.433 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -113.13 134.4 21.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.59 0.709 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 147.4 62.32 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.644 2.23 . . . . 0.0 112.388 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -54.89 -31.62 60.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.923 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -62.67 -21.95 66.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -93.41 -20.44 20.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -70.56 135.78 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.143 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.41 -57.34 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -171.67 178.33 3.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.0 p -55.76 161.22 2.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HE2' HD12 ' A' ' 82' ' ' LEU . 12.3 tttm -131.85 -51.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.913 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.5 t -150.57 141.97 16.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.079 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -106.66 114.45 28.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -148.68 156.89 43.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -125.65 107.97 11.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE3' HD23 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -142.2 126.0 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.869 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 tt -138.08 138.98 39.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.644 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -152.18 169.39 22.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.731 ' O ' HD13 ' A' ' 58' ' ' LEU . 21.4 mt -122.82 135.79 61.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.085 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.735 HG22 HD22 ' A' ' 58' ' ' LEU . 14.1 t -129.52 137.5 56.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.094 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.631 ' OD2' HD11 ' A' ' 59' ' ' LEU . 2.0 t70 -86.12 123.26 31.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.4 mtp -69.17 -9.95 55.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.06 -54.2 28.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.955 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -122.15 10.03 9.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 55.94 35.94 26.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -111.48 158.2 19.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.735 HD22 HG22 ' A' ' 51' ' ' VAL . 2.1 mm? -76.14 152.25 36.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.896 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.631 HD11 ' OD2' ' A' ' 52' ' ' ASP . 64.4 mt -129.84 -172.63 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.943 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -114.48 -16.13 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 p -134.78 176.85 8.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.2 t -107.57 108.55 19.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.8 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -107.8 173.43 6.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -67.87 -29.18 68.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-20 -91.48 13.25 18.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.484 ' OG ' HG22 ' A' ' 50' ' ' ILE . 28.4 t -130.98 158.32 40.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.6 t -133.58 135.76 55.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.5 t -77.96 140.45 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.114 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.738 HD11 HD23 ' A' ' 107' ' ' LEU . 11.4 mt -131.91 131.09 42.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.481 HG12 ' OD1' ' A' ' 72' ' ' ASN . 14.4 t -112.83 103.96 16.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.142 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.6 HD21 HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -94.67 96.58 9.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.481 ' OD1' HG12 ' A' ' 70' ' ' VAL . 9.2 p-10 -175.94 -168.9 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.868 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 68.01 0.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 83' ' ' CYS . 13.3 mt -81.24 141.24 15.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.75 168.83 18.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -106.49 163.56 12.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.59 168.01 11.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.099 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -68.26 -27.61 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -95.61 26.6 3.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.888 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt 64.22 15.52 9.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.8 m -82.59 146.46 29.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.834 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' ' 82' ' ' LEU . 0.4 OUTLIER -103.5 149.64 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.424 ' O ' HG23 ' A' ' 74' ' ' ILE . 20.7 p -151.14 162.72 40.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.4 ttm -126.14 150.06 48.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.822 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -87.29 128.24 8.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.507 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.429 ' CD1' HG11 ' A' ' 28' ' ' VAL . 39.7 mt -146.2 111.86 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.811 0.338 . . . . 0.0 111.115 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.17 47.52 11.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 63.7 16.25 9.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -127.44 124.15 37.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -85.72 117.54 24.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -109.14 130.7 55.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.34 48.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.905 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.679 HD12 ' HZ ' ' A' ' 19' ' ' PHE . 4.7 pt -118.24 133.5 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.105 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 93' ' ' ILE . 4.6 mm? -127.16 159.46 64.94 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.622 0.725 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 53.6 Cg_endo -69.76 148.87 65.99 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 0.0 112.361 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -59.93 -20.14 55.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 49.5 m -69.23 -17.28 63.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -0.43 41.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -51.17 165.97 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 96.93 -41.47 2.34 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.5 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.41 -21.31 11.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.865 0.364 . . . . 0.0 111.116 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.13 146.68 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.163 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -129.45 166.33 19.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.947 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.48 168.02 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.095 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.612 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -68.52 164.89 20.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.612 ' N ' HD12 ' A' ' 105' ' ' LEU . 21.4 mtt85 -111.93 139.41 47.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.738 HD23 HD11 ' A' ' 69' ' ' LEU . 0.5 OUTLIER -71.65 -14.83 62.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.921 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -62.22 -17.06 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -78.78 -2.95 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.997 ' O ' ' C ' ' A' ' 110' ' ' PHE . 22.5 m-85 . . . . . 1 C--O 2.0 40.583 1 CA-C-O 161.141 19.543 . . . . 0.0 110.877 179.99 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -119.94 141.9 49.22 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . 0.263 23.8 p 58.45 7.34 0.69 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.848 2.859 . . . . 0.0 113.622 -179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 m -65.6 -0.48 2.06 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.558 2.743 . . . . 0.0 115.346 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -138.83 129.69 26.44 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.949 1.249 . . . . 0.0 107.705 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -148.46 179.13 8.03 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 126.206 1.802 . . . . 0.0 108.107 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -70.96 161.33 31.28 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 t -129.61 140.15 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 105.785 -1.932 . . . . 0.0 105.785 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -103.3 118.26 36.36 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.22 146.08 24.59 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -62.35 -34.87 77.51 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 64.28 133.59 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.702 2.001 . . . . 0.0 111.846 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.51 19.59 58.05 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.073 -1.017 . . . . 0.0 112.1 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.11 178.07 7.35 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.855 2.062 . . . . 0.0 109.983 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -169.56 0.78 Allowed 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.372 2.269 . . . . 0.0 107.771 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.2 p -79.96 120.74 24.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.378 -1.451 . . . . 0.0 107.743 -176.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -167.66 138.85 2.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.399 3.08 . . . . 0.0 106.117 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 35.9 p90 -162.15 177.94 9.23 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 123.561 0.744 . . . . 0.0 109.749 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 mt -137.93 122.92 23.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 C-N-CA 123.624 0.77 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 71.6 t80 -131.65 142.94 49.97 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.44 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 23.4 t70 56.32 34.31 23.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.809 1.244 . . . . 0.0 108.852 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 m120 62.35 12.05 4.98 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.254 2.222 . . . . 0.0 112.289 -178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.36 146.47 39.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 119.223 0.92 . . . . 0.0 109.235 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.1 m -75.38 133.48 41.18 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.302 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.6 m-85 -141.84 162.09 36.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.611 1.565 . . . . 0.0 109.123 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -148.56 161.73 41.08 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 121.031 -1.043 . . . . 0.0 108.619 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.79 130.76 40.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -100.19 169.83 8.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.128 0.971 . . . . 0.0 111.385 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.76 -14.63 61.15 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 126.935 2.094 . . . . 0.0 111.797 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -69.91 124.36 23.83 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 124.801 1.24 . . . . 0.0 109.693 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.32 144.74 40.02 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.421 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -123.74 138.7 30.85 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.384 1.474 . . . . 0.0 107.807 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.33 153.51 50.72 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.392 2.061 . . . . 0.0 112.646 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -50.39 -33.84 22.1 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 126.298 1.839 . . . . 0.0 114.45 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -67.82 -27.56 66.83 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.344 0.658 . . . . 0.0 111.625 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -82.45 -24.76 34.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -67.13 119.51 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -74.21 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.58 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.62 172.37 15.48 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.06 0.544 . . . . 0.0 111.2 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.1 t -60.74 157.86 13.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.411 1.484 . . . . 0.0 108.722 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.544 ' HE2' ' CD1' ' A' ' 82' ' ' LEU . 3.7 tttp -133.43 -51.22 0.87 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 117.498 -1.239 . . . . 0.0 111.299 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -144.28 112.05 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.258 0.936 . . . . 0.0 111.408 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -84.41 92.62 8.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.41 156.65 38.5 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 130.019 3.328 . . . . 0.0 105.981 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -135.93 121.63 19.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.714 1.605 . . . . 0.0 110.145 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.482 ' CE ' HD23 ' A' ' 49' ' ' LEU . 3.7 tmtm? -147.45 132.77 18.5 Favored 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tt -134.45 143.23 47.41 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 126.924 2.09 . . . . 0.0 106.249 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.482 HD23 ' CE ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -157.61 167.56 29.79 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.747 1.619 . . . . 0.0 107.695 178.113 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.5 mt -126.62 127.42 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.0 t -112.48 139.85 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.069 1.347 . . . . 0.0 109.584 -179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -87.01 120.86 28.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.153 1.381 . . . . 0.0 108.507 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.6 mtp -64.72 -21.07 66.67 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -77.01 -53.49 7.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 120.967 1.712 . . . . 0.0 111.937 -179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.5 m -96.9 -6.51 35.58 Favored 'General case' 0 CA--C 1.523 -0.072 0 CA-C-O 118.097 -0.954 . . . . 0.0 113.394 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 65.15 21.9 12.2 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -101.22 157.43 16.78 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 124.823 1.249 . . . . 0.0 111.088 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.82 152.83 33.26 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.409 ' CD1' HD22 ' A' ' 63' ' ' ASN . 69.0 mt -127.21 169.09 13.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.128 0.971 . . . . 0.0 109.814 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.2 p -109.99 11.56 23.96 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 126.988 2.115 . . . . 0.0 108.991 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.3 p -155.0 169.23 24.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.045 1.338 . . . . 0.0 111.714 -179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.8 t -101.62 110.84 22.91 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.409 HD22 ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -117.64 157.2 26.85 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.573 0.749 . . . . 0.0 109.206 178.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -32.25 69.94 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.628 1.558 . . . . 0.0 113.704 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -85.02 15.43 4.07 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.353 1.061 . . . . 0.0 109.896 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 p -120.88 162.85 19.12 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.676 1.19 . . . . 0.0 110.55 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.5 t -137.77 130.63 41.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.3 t -80.25 134.09 36.06 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 106.039 -1.838 . . . . 0.0 106.039 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.3 125.51 43.63 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 t -104.69 103.01 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 102.879 -3.008 . . . . 0.0 102.879 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -96.34 91.86 6.05 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -168.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -175.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 48.07 67.17 0.88 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.825 1.25 . . . . 0.0 111.598 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -72.02 144.9 12.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.932 1.293 . . . . 0.0 111.697 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -138.25 169.25 18.12 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.295 2.238 . . . . 0.0 110.403 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -117.15 162.71 17.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.123 2.169 . . . . 0.0 108.139 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.15 175.41 6.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.396 1.878 . . . . 0.0 111.358 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -53.27 -48.04 68.63 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.03 1.732 . . . . 0.0 111.754 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -85.48 18.86 2.56 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.083 -1.01 . . . . 0.0 111.936 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.11 8.91 5.98 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.534 1.933 . . . . 0.0 109.723 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -64.52 157.03 27.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.544 ' CD1' ' HE2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -116.17 155.28 28.54 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.334 -0.854 . . . . 0.0 111.361 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.9 p -151.54 168.89 23.51 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.6 ttm -135.98 143.65 44.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.724 1.609 . . . . 0.0 109.737 -178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.73 125.37 7.03 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 109.796 -1.321 . . . . 0.0 109.796 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mt -143.38 121.73 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 50.84 35.72 12.92 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.574 0.75 . . . . 0.0 111.084 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 74.63 12.51 3.75 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 126.17 1.788 . . . . 0.0 114.31 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -120.04 135.64 54.86 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.639 1.175 . . . . 0.0 109.006 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -88.86 115.83 26.7 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.476 0.711 . . . . 0.0 110.591 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -109.18 131.54 54.97 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.517 1.127 . . . . 0.0 111.247 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.421 ' HB2' HD13 ' A' ' 33' ' ' ILE . 10.6 ttpt -65.77 148.74 51.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.977 0.911 . . . . 0.0 110.31 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.414 HD11 ' HB3' ' A' ' 82' ' ' LEU . 1.3 pt -117.65 133.04 65.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -121.61 159.72 49.45 Favored Pre-proline 0 N--CA 1.467 0.405 0 C-N-CA 125.575 1.55 . . . . 0.0 109.21 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -71.98 151.36 56.13 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.07 1.847 . . . . 0.0 109.022 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.01 -5.68 5.01 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 p -80.16 -23.68 40.9 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.133 1.373 . . . . 0.0 111.181 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -72.31 -0.26 11.8 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.305 1.842 . . . . 0.0 114.539 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.1 mmtt -51.85 157.09 1.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.976 1.311 . . . . 0.0 111.272 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.1 -26.37 17.41 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.465 1.031 . . . . 0.0 111.483 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.03 -12.44 11.97 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.15 1.38 . . . . 0.0 110.149 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.8 p -150.26 150.27 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 C-N-CA 124.743 1.217 . . . . 0.0 108.127 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -129.82 173.0 11.08 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.895 2.478 . . . . 0.0 105.336 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 166.35 5.38 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.867 0.841 . . . . 0.0 111.043 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -61.58 162.48 8.25 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.012 0.925 . . . . 0.0 110.162 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.572 ' N ' HD12 ' A' ' 105' ' ' LEU . 86.2 mtt180 -111.5 138.82 47.52 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.445 0.698 . . . . 0.0 112.169 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.437 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.1 OUTLIER -70.61 -16.4 62.83 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.172 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -67.61 -3.82 10.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.637 1.175 . . . . 0.0 112.855 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -90.73 4.2 52.21 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 120.858 -1.152 . . . . 0.0 110.251 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 126.437 1.895 . . . . 0.0 107.994 -178.803 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -156.44 138.29 14.33 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.227 -0.921 . . . . 0.0 109.105 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.61 137.47 26.73 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.247 1.419 . . . . 0.0 108.87 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.6 p -156.44 164.37 38.33 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.38 -0.825 . . . . 0.0 111.52 -179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -151.24 127.39 10.51 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 126.639 1.976 . . . . 0.0 111.892 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -156.79 158.54 37.01 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.115 1.766 . . . . 0.0 107.608 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -63.75 150.83 43.67 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 t -107.32 136.98 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.7 119.12 38.46 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 106.147 -1.798 . . . . 0.0 106.147 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -93.54 172.21 8.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.871 1.268 . . . . 0.0 110.125 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -65.02 -25.4 67.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 128.39 2.676 . . . . 0.0 114.695 178.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 45.12 92.96 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.919 2.087 . . . . 0.0 114.264 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 31.55 50.52 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 113.325 -1.761 . . . . 0.0 113.18 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -136.01 -178.96 5.38 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 127.392 2.277 . . . . 0.0 110.434 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.99 -170.99 0.8 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.873 1.269 . . . . 0.0 108.404 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -79.13 120.44 23.66 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.783 -1.823 . . . . 0.0 110.274 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -168.99 145.47 3.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.014 2.926 . . . . 0.0 107.421 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.475 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 45.4 p90 -165.15 166.42 19.03 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mp -123.16 121.87 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 120.886 -1.134 . . . . 0.0 108.715 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -131.82 140.31 49.11 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 55.23 36.69 27.56 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.29 1.036 . . . . 0.0 110.72 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 m120 59.49 18.91 7.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.886 1.674 . . . . 0.0 112.753 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.95 140.01 50.7 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 126.273 1.829 . . . . 0.0 106.148 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 m -80.0 140.51 36.56 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.5 m-85 -140.83 162.83 34.5 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.479 1.912 . . . . 0.0 110.72 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CD1' ' HE2' ' A' ' 99' ' ' LYS . 47.6 p90 -149.46 159.78 44.01 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.9 1.28 . . . . 0.0 109.64 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.5 t -89.06 133.47 31.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -99.67 169.95 8.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.206 1.003 . . . . 0.0 111.454 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -71.95 -21.01 61.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.64 2.776 . . . . 0.0 112.751 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 126.45 30.75 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.336 1.454 . . . . 0.0 112.711 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -99.31 147.68 24.94 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.82 2.048 . . . . 0.0 109.418 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.411 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -114.3 127.41 26.85 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.26 148.1 79.62 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 121.57 1.513 . . . . 0.0 110.666 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.74 -27.22 49.45 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -72.02 -19.79 61.8 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.441 0.696 . . . . 0.0 111.94 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -90.55 -21.66 21.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.72 -0.612 . . . . 0.0 110.102 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 82.5 t -59.49 137.26 22.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 124.905 1.282 . . . . 0.0 107.736 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.3 t-20 -91.12 -61.66 1.61 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 118.538 -0.744 . . . . 0.0 109.16 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -161.29 167.56 25.67 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.049 0.84 . . . . 0.0 112.057 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 36.9 m -69.4 133.79 48.22 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.769 1.228 . . . . 0.0 108.741 178.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -57.02 2.09 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 117.697 -1.145 . . . . 0.0 111.902 -178.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.1 t -141.0 121.99 13.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -84.98 117.6 24.06 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 105.025 -2.213 . . . . 0.0 105.025 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.19 159.74 43.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 128.584 2.754 . . . . 0.0 109.541 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -141.33 121.4 13.74 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.112 -0.992 . . . . 0.0 108.908 177.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 48' ' ' LEU . 2.1 tmtm? -148.14 137.44 22.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.463 ' N ' ' HD3' ' A' ' 47' ' ' LYS . 8.3 tt -134.93 143.29 46.82 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.775 2.03 . . . . 0.0 108.211 177.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -155.69 170.0 23.04 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.439 1.496 . . . . 0.0 109.539 177.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 mt -129.46 129.76 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.3 t -128.36 134.04 65.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.473 1.109 . . . . 0.0 111.04 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -71.13 117.52 12.75 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 128.12 2.568 . . . . 0.0 108.06 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.6 mtp -67.83 -23.27 65.15 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.833 1.197 . . . . 0.0 113.314 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -69.61 -53.37 19.15 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.972 0.805 . . . . 0.0 110.21 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.1 m -106.78 -2.93 20.98 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 117.07 2.248 . . . . 0.0 117.07 -177.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 59.05 35.08 23.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.823 1.249 . . . . 0.0 112.128 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -116.73 148.37 41.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.482 1.113 . . . . 0.0 109.289 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.7 155.05 40.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 79.1 mt -131.3 170.59 14.4 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 109.807 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.4 p -92.36 -27.48 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.669 1.187 . . . . 0.0 112.714 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.0 m -135.83 163.33 30.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.06 1.344 . . . . 0.0 110.392 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -88.11 109.74 20.11 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.453 1.501 . . . . 0.0 110.166 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -119.09 157.95 26.83 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -55.81 -18.75 9.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -92.04 7.8 40.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 119.538 1.063 . . . . 0.0 110.356 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 t -133.83 166.89 21.61 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.473 1.909 . . . . 0.0 111.041 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -142.2 156.21 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.99 1.716 . . . . 0.0 107.878 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.2 t -105.69 143.9 33.19 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.27 1.428 . . . . 0.0 108.577 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.44 133.69 44.17 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.0 t -104.52 102.3 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 103.846 -2.65 . . . . 0.0 103.846 178.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -82.83 95.62 7.97 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -163.55 -173.42 3.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 47.27 68.77 0.59 Allowed 'General case' 0 C--N 1.342 0.248 0 C-N-CA 127.694 2.398 . . . . 0.0 112.705 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.5 mt -72.45 140.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 44.5 m-85 -134.64 170.27 16.05 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 127.284 2.233 . . . . 0.0 109.218 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.65 152.62 34.82 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 126.077 1.751 . . . . 0.0 108.079 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.8 165.57 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.965 1.706 . . . . 0.0 109.216 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.2 t -61.56 -24.77 66.88 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.896 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -81.88 7.93 11.63 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.577 2.351 . . . . 0.0 110.042 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt 68.84 -0.8 2.24 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.32 2.248 . . . . 0.0 109.794 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.1 t -75.16 168.57 19.73 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.434 ' CB ' HD11 ' A' ' 93' ' ' ILE . 2.0 mm? -114.81 156.18 25.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.401 1.081 . . . . 0.0 111.853 -178.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.3 p -145.8 166.48 25.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.842 0.857 . . . . 0.0 110.384 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 52.9 ttm -132.52 140.15 48.2 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.889 1.676 . . . . 0.0 109.285 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.15 110.23 3.31 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 124.884 1.23 . . . . 0.0 112.838 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.8 mt -130.55 124.37 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 49.59 53.67 12.33 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.436 2.294 . . . . 0.0 109.233 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 59.95 11.8 2.79 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.861 2.065 . . . . 0.0 114.825 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -119.43 132.89 55.9 Favored 'General case' 0 CA--C 1.514 -0.405 0 O-C-N 120.95 -1.094 . . . . 0.0 109.715 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -86.17 115.82 23.98 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -108.44 132.2 54.02 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.179 0.992 . . . . 0.0 110.56 -178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.411 ' HB2' HD13 ' A' ' 33' ' ' ILE . 16.9 ttpt -65.26 151.17 46.85 Favored 'General case' 0 C--O 1.238 0.449 0 O-C-N 122.053 -0.405 . . . . 0.0 111.023 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.475 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -117.25 133.22 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.26 157.7 55.11 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 125.274 1.43 . . . . 0.0 109.208 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.27 153.78 56.43 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.031 3.154 . . . . 0.0 110.846 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.57 -17.93 57.08 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.111 0.564 . . . . 0.0 111.544 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.9 m -77.0 -20.73 55.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.057 -0.497 . . . . 0.0 111.993 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.77 -0.16 41.85 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.901 0.773 . . . . 0.0 110.737 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.442 ' HE2' ' CD1' ' A' ' 27' ' ' PHE . 61.7 mmtt -59.98 150.75 28.07 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 102.09 -31.9 8.16 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 109.136 -1.585 . . . . 0.0 109.136 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.2 -19.36 14.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.93 1.692 . . . . 0.0 110.167 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.79 154.16 10.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 127.407 2.283 . . . . 0.0 106.854 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -131.34 170.87 14.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.718 1.607 . . . . 0.0 108.622 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.43 165.2 14.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.9 168.4 13.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -113.25 140.23 48.14 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 125.159 1.384 . . . . 0.0 109.454 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.406 ' H ' HD12 ' A' ' 107' ' ' LEU . 2.6 mp -71.47 -13.2 61.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.108 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -56.93 -26.72 59.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.949 0.9 . . . . 0.0 111.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -64.38 -19.65 65.62 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.197 1.399 . . . . 0.0 112.821 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.375 1.87 . . . . 0.0 111.646 -177.012 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 16.4 t80 . . . . . 0 CA--C 1.533 0.289 0 CA-C-O 121.13 0.491 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.2 mm-40 -155.84 69.67 0.68 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.0 p -143.92 163.83 32.3 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.799 0.84 . . . . 0.0 110.162 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 p -115.61 -61.42 1.74 Allowed 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.025 1.33 . . . . 0.0 109.13 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -71.63 -37.21 70.91 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt 52.22 43.75 30.35 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.068 1.347 . . . . 0.0 109.945 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -48.81 138.79 10.72 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.933 0.893 . . . . 0.0 111.047 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -90.55 118.7 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.462 ' HD2' HD13 ' A' ' 20' ' ' ILE . 10.8 ttm180 -84.59 100.65 11.56 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.42 138.94 40.68 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -64.95 -34.67 78.96 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 115.351 1.611 . . . . 0.0 115.351 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 57.86 139.86 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.899 2.079 . . . . 0.0 114.751 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.36 15.87 52.97 Favored Glycine 0 CA--C 1.534 1.273 0 O-C-N 121.156 -0.965 . . . . 0.0 111.965 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.11 177.33 7.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 127.644 2.378 . . . . 0.0 108.914 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -167.31 0.49 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 131.038 3.735 . . . . 0.0 109.24 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.285 24.2 p -78.76 119.07 21.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 123.771 1.748 . . . . 0.0 106.985 -176.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.13 139.75 2.87 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 130.974 3.71 . . . . 0.0 107.676 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -162.6 156.75 21.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 128.116 2.566 . . . . 0.0 107.08 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.462 HD13 ' HD2' ' A' ' 10' ' ' ARG . 2.2 mp -118.92 126.24 75.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 123.618 0.767 . . . . 0.0 108.971 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -131.5 138.66 49.06 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.291 1.036 . . . . 0.0 110.046 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.9 t70 54.05 34.16 19.24 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.343 1.857 . . . . 0.0 113.071 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 66.02 31.48 9.03 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 0.0 110.923 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -134.62 127.66 31.62 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 126.168 1.787 . . . . 0.0 106.641 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.6 m -76.16 132.11 39.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.95 172.59 9.27 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 127.951 2.5 . . . . 0.0 111.797 -177.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.316 25.9 p90 -153.19 144.79 23.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 129.486 3.114 . . . . 0.0 113.63 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' ILE . 47.3 t -82.52 133.84 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.6 p -103.57 167.88 9.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.694 1.198 . . . . 0.0 110.107 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -72.14 -12.0 61.0 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.895 1.678 . . . . 0.0 113.201 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 111.44 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.911 1.284 . . . . 0.0 113.238 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.409 ' C ' HD12 ' A' ' 33' ' ' ILE . 57.7 tt0 -89.92 146.71 24.2 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.424 1.49 . . . . 0.0 109.29 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.409 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.68 140.04 24.84 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.697 1.599 . . . . 0.0 107.929 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.81 150.35 61.69 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.817 . . . . 0.0 110.672 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -61.37 -19.42 61.84 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.51 -21.44 60.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.375 0.67 . . . . 0.0 110.588 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -87.69 -20.04 26.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.836 0.454 . . . . 0.0 111.554 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.0 t -61.3 130.45 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -89.87 -57.96 2.68 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.505 1.122 . . . . 0.0 110.5 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -164.05 172.33 13.96 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.079 0.952 . . . . 0.0 110.514 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.8 p -68.16 162.7 24.25 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -137.28 -45.07 0.56 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.33 122.81 2.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 118.598 0.635 . . . . 0.0 112.069 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -99.9 112.13 24.41 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -150.05 156.45 41.69 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 129.302 3.041 . . . . 0.0 104.893 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -131.8 119.36 21.15 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.46 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -148.12 135.12 20.21 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.46 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.1 tt -137.88 138.18 38.81 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 127.238 2.215 . . . . 0.0 109.147 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -144.42 169.65 17.53 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.991 0.916 . . . . 0.0 110.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.59 128.29 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.042 1.337 . . . . 0.0 107.957 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.67 134.68 65.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 124.799 1.24 . . . . 0.0 108.839 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -76.92 124.24 27.47 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 54.4 mtp -68.79 -29.76 68.18 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 120.255 -1.528 . . . . 0.0 112.887 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -79.48 -53.33 6.99 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.526 0.73 . . . . 0.0 110.784 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -81.48 -17.03 50.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.95 -1.024 . . . . 0.0 111.76 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 59.87 37.44 21.69 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.28 0.945 . . . . 0.0 109.664 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -129.42 161.38 30.5 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.411 1.084 . . . . 0.0 112.392 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.47 147.08 40.13 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.119 0.887 . . . . 0.0 110.061 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.8 mt -131.54 170.49 14.65 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.801 1.24 . . . . 0.0 112.112 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.83 -44.8 8.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.1 161.12 22.3 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.217 1.007 . . . . 0.0 112.665 -177.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.8 p -80.71 96.59 6.96 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -77.23 168.21 20.44 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 105.585 -2.006 . . . . 0.0 105.585 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -69.95 -23.32 63.17 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -80.93 2.95 24.52 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 m -119.28 161.0 21.15 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.653 1.181 . . . . 0.0 112.581 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 55.9 t -136.66 154.95 32.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 126.501 1.92 . . . . 0.0 106.144 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.65 143.47 37.67 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.525 HD21 HD23 ' A' ' 107' ' ' LEU . 2.0 mm? -125.54 145.52 50.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -116.46 103.06 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -101.81 94.54 5.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -164.97 -173.35 2.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.176 -177.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 51.35 68.09 0.85 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.058 0.943 . . . . 0.0 113.241 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mt -74.68 143.86 12.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 124.903 1.281 . . . . 0.0 109.155 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -136.64 170.22 16.42 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.381 2.272 . . . . 0.0 109.868 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -116.97 157.77 25.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 126.316 1.846 . . . . 0.0 107.699 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.29 165.47 15.43 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.38 1.472 . . . . 0.0 111.463 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.5 t -56.08 -36.32 67.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.587 1.555 . . . . 0.0 111.326 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -87.99 17.93 4.59 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.667 0.787 . . . . 0.0 110.969 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt 67.61 3.25 3.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.372 1.869 . . . . 0.0 111.914 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.0 m -68.63 154.87 41.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.2 mt -114.63 147.58 39.35 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.4 p -142.52 169.08 18.25 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.734 0.414 . . . . 0.0 110.987 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 tpp -128.79 140.15 51.85 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.085 2.154 . . . . 0.0 108.464 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -88.27 115.63 4.43 Favored Glycine 0 N--CA 1.462 0.391 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 45.5 mt -132.09 119.98 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.5 m120 50.5 47.09 24.65 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 122.1 0.953 . . . . 0.0 111.139 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 62.7 9.94 3.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 128.69 2.796 . . . . 0.0 113.672 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -112.08 125.3 53.95 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.613 1.565 . . . . 0.0 107.989 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -86.14 116.03 24.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.43 132.11 54.1 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.573 1.149 . . . . 0.0 109.402 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -63.61 155.46 29.62 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.465 0.706 . . . . 0.0 112.632 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -124.62 132.69 70.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 178.435 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.29 160.05 59.57 Favored Pre-proline 0 N--CA 1.474 0.767 0 C-N-CA 126.026 1.73 . . . . 0.0 110.248 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.52 152.32 78.62 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 109.835 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -60.64 -14.82 22.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.56 -0.257 . . . . 0.0 111.666 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.92 -13.64 62.55 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.283 -0.886 . . . . 0.0 110.953 177.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -2.75 40.53 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.829 1.195 . . . . 0.0 111.277 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp -52.47 152.16 3.72 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 120.846 -1.159 . . . . 0.0 110.954 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.68 -42.34 3.04 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -95.65 -14.0 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.211 1.506 . . . . 0.0 110.9 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 20.0 t -143.13 155.06 16.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 C-N-CA 126.818 2.047 . . . . 0.0 106.996 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -133.75 162.38 32.12 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.208 1.003 . . . . 0.0 109.08 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.33 159.7 26.19 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 165.09 13.56 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -125.27 140.34 52.92 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.711 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.0 OUTLIER -65.04 -12.85 55.13 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 126.369 1.868 . . . . 0.0 112.692 179.671 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.31 -16.68 48.31 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.417 1.008 . . . . 0.0 112.15 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -81.49 -5.02 57.53 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 110.981 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.873 2.069 . . . . 0.0 107.045 -179.705 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.45 160.3 16.58 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.469 1.908 . . . . 0.0 111.26 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -130.0 25.71 5.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.919 1.288 . . . . 0.0 113.797 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 t 56.51 17.89 3.25 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 120.887 -1.133 . . . . 0.0 113.625 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 56.73 32.39 21.1 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.353 1.461 . . . . 0.0 113.245 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 10.6 mmpt? -127.86 159.04 36.13 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.602 1.561 . . . . 0.0 109.113 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.25 171.97 13.02 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.956 1.303 . . . . 0.0 109.488 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.2 t -124.45 144.16 35.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 124.414 1.086 . . . . 0.0 110.26 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -112.56 138.13 49.8 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -113.41 152.17 30.4 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.69 -25.84 68.12 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.659 0.784 . . . . 0.0 111.622 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.8 137.99 0.03 OUTLIER 'General case' 0 C--O 1.236 0.383 0 C-N-CA 129.327 3.051 . . . . 0.0 112.022 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.95 38.04 30.38 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.881 1.229 . . . . 0.0 111.545 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -139.82 179.04 6.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.347 1.859 . . . . 0.0 112.307 -176.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -74.67 -169.19 0.82 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.532 2.733 . . . . 0.0 107.91 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.254 22.8 p -80.16 120.46 24.32 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 119.385 -2.072 . . . . 0.0 109.363 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -168.83 143.41 3.18 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 129.604 3.161 . . . . 0.0 106.548 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 41.3 p90 -164.44 173.17 12.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 119.285 0.948 . . . . 0.0 109.139 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -130.67 123.27 54.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 O-C-N 121.538 -0.726 . . . . 0.0 109.512 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -137.26 145.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 104.632 -2.358 . . . . 0.0 104.632 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.1 t0 53.47 35.33 20.38 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 122.419 1.104 . . . . 0.0 111.399 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 57.59 22.83 8.61 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.347 1.859 . . . . 0.0 113.126 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -123.41 150.77 43.36 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.618 1.567 . . . . 0.0 109.305 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.8 m -79.29 123.05 27.08 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 8.4 m-85 -127.5 161.35 28.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.423 1.489 . . . . 0.0 109.087 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' CE2' HG22 ' A' ' 29' ' ' THR . 31.3 p90 -149.17 167.38 26.12 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.004 -1.06 . . . . 0.0 108.408 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -97.45 127.58 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 ' CE2' ' A' ' 27' ' ' PHE . 30.3 p -94.99 167.49 11.36 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.752 1.221 . . . . 0.0 111.689 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -75.15 -13.0 60.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.978 1.711 . . . . 0.0 111.988 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' HG13 ' A' ' 102' ' ' VAL . 1.7 mptp? -69.59 102.77 1.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.645 1.578 . . . . 0.0 109.6 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -89.93 145.64 24.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.47 139.93 22.55 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.599 1.959 . . . . 0.0 108.823 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.59 148.61 20.59 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.26 2.64 . . . . 0.0 109.893 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -55.27 -31.97 61.99 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.26 -19.39 64.51 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.58 0.752 . . . . 0.0 112.629 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -101.84 -9.76 20.48 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.523 0.729 . . . . 0.0 111.064 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.6 t -74.87 124.2 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -73.66 -59.57 2.65 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.375 1.07 . . . . 0.0 110.799 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.7 p30 -171.19 169.07 6.58 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 126.172 1.789 . . . . 0.0 109.63 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 57.5 p -62.48 169.61 2.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.301 1.84 . . . . 0.0 112.913 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -140.51 -47.71 0.43 Allowed 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 116.746 -1.597 . . . . 0.0 114.364 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 t -153.06 130.02 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 121.248 1.84 . . . . 0.0 111.416 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -99.29 106.13 18.22 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.296 1.038 . . . . 0.0 111.042 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -128.87 158.04 39.87 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 129.65 3.18 . . . . 0.0 106.166 178.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.03 109.83 6.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.487 1.04 . . . . 0.0 109.761 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.36 139.0 22.85 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.985 0.811 . . . . 0.0 109.898 178.037 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.506 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.2 tt -133.53 141.76 47.89 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.465 1.506 . . . . 0.0 108.53 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.584 HD11 HD21 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -148.92 171.16 16.78 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.183 1.393 . . . . 0.0 110.74 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.4 mt -127.3 142.57 43.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.76 1.224 . . . . 0.0 110.725 -178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -137.48 128.83 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.711 1.204 . . . . 0.0 111.712 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.48 ' HB2' HD21 ' A' ' 59' ' ' LEU . 9.4 t0 -73.62 111.48 8.8 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.801 1.64 . . . . 0.0 108.041 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 63.0 mtp -56.99 -25.22 57.96 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.355 1.434 . . . . 0.0 113.494 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? -60.09 -53.52 56.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.947 0.499 . . . . 0.0 111.05 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.5 m -106.12 -6.54 18.53 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 59.57 30.84 20.51 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.803 2.041 . . . . 0.0 109.878 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.94 154.01 24.71 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 124.923 1.289 . . . . 0.0 112.34 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.11 150.1 49.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.22 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.48 HD21 ' HB2' ' A' ' 52' ' ' ASP . 54.3 mt -127.45 174.31 9.11 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 124.417 1.087 . . . . 0.0 110.781 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -108.96 0.45 20.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.802 2.041 . . . . 0.0 113.028 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.1 p -163.01 162.98 26.22 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.543 1.137 . . . . 0.0 108.413 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.7 m -91.72 117.43 29.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.486 1.914 . . . . 0.0 112.818 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -124.35 157.22 35.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.97 1.708 . . . . 0.0 109.317 177.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -56.28 -18.03 9.39 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -96.66 4.18 52.04 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.364 0.666 . . . . 0.0 111.072 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.5 t -120.32 169.53 10.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.995 2.118 . . . . 0.0 107.92 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 92.5 t -143.47 145.38 22.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 t -95.46 142.18 28.13 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 106.479 -1.675 . . . . 0.0 106.479 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.2 mt -123.6 151.73 42.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.7 t -128.49 104.33 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 105.332 -2.099 . . . . 0.0 105.332 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 49' ' ' LEU . 2.1 mm? -97.94 95.12 7.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.601 1.092 . . . . 0.0 109.837 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -167.49 -167.75 0.93 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 56.0 67.9 0.94 Allowed 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.418 1.087 . . . . 0.0 113.701 175.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.3 mt -77.87 139.99 17.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 121.195 -0.941 . . . . 0.0 109.038 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.82 168.41 19.88 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.834 2.054 . . . . 0.0 109.229 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -115.23 151.22 34.87 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 126.363 1.865 . . . . 0.0 107.204 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.12 159.99 16.43 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.527 1.531 . . . . 0.0 109.837 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -59.54 -33.24 71.15 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.986 0.914 . . . . 0.0 110.779 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -83.05 17.0 2.1 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.877 1.271 . . . . 0.0 110.405 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp 68.65 2.09 3.29 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.84 2.056 . . . . 0.0 111.142 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 44.3 m -70.01 160.98 30.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.95 146.09 41.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.542 1.137 . . . . 0.0 108.145 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.2 p -142.48 167.14 22.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.542 -0.724 . . . . 0.0 110.609 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 36.0 ttm -134.13 137.47 44.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.552 1.941 . . . . 0.0 109.029 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.6 123.38 6.03 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 127.336 2.398 . . . . 0.0 111.087 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.7 mt -138.98 117.32 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 50.67 43.69 27.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.901 0.881 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 73.94 -1.28 3.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.123 2.569 . . . . 0.0 115.357 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -105.45 134.76 48.04 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.968 1.307 . . . . 0.0 108.6 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -89.89 117.09 28.45 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.12 0.568 . . . . 0.0 109.819 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -109.02 130.24 55.47 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.289 1.436 . . . . 0.0 110.742 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -62.89 147.76 49.29 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.308 0.643 . . . . 0.0 110.387 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -115.95 133.46 62.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.21 161.05 56.56 Favored Pre-proline 0 C--O 1.236 0.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.952 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -74.95 144.29 30.26 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 122.696 2.264 . . . . 0.0 109.05 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -58.11 -18.18 23.31 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.78 -11.1 59.99 Favored 'General case' 0 N--CA 1.445 -0.71 0 O-C-N 121.006 -1.059 . . . . 0.0 112.571 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.5 1.66 28.5 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.34 1.427 . . . . 0.0 112.426 178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -46.11 144.42 1.94 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 126.606 1.962 . . . . 0.0 112.279 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.43 -43.11 1.94 Allowed Glycine 0 CA--C 1.518 0.251 0 C-N-CA 127.172 2.32 . . . . 0.0 110.662 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.06 -18.17 22.1 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 117.936 0.868 . . . . 0.0 110.457 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.4 HG13 ' HE2' ' A' ' 31' ' ' LYS . 2.0 t -138.62 158.1 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 125.832 1.653 . . . . 0.0 107.713 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -141.98 168.63 19.28 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 127.938 2.495 . . . . 0.0 106.629 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.63 -179.66 1.46 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.744 0.783 . . . . 0.0 111.038 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.95 173.25 10.23 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -123.39 141.86 51.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.719 1.208 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.429 ' H ' HD12 ' A' ' 107' ' ' LEU . 1.1 mp -69.97 -8.84 52.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.403 0.681 . . . . 0.0 111.787 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.24 -22.37 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.964 1.706 . . . . 0.0 110.942 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.97 -5.57 49.16 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.833 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 124.843 1.257 . . . . 0.0 111.556 -177.979 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -129.78 125.45 35.82 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.204 1.002 . . . . 0.0 109.223 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.4 t -104.39 165.11 11.27 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.499 1.52 . . . . 0.0 108.359 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.04 -33.17 0.45 Allowed 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 49.76 63.47 2.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 120.513 1.506 . . . . 0.0 110.692 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -122.42 174.97 6.7 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.375 1.47 . . . . 0.0 109.276 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 14.6 ttmm -99.75 168.61 9.8 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.417 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 24.1 t -126.71 126.12 68.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -91.67 135.72 33.67 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -106.18 165.35 11.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.49 -33.54 48.11 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 53.19 98.08 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.996 1.718 . . . . 0.0 113.386 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 9.25 37.46 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 125.466 1.508 . . . . 0.0 112.955 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.9 m -131.6 178.68 6.55 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 127.39 2.276 . . . . 0.0 109.469 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.4 -167.9 0.48 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 130.733 3.613 . . . . 0.0 107.833 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.4 p -78.87 121.13 24.44 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 124.317 2.008 . . . . 0.0 109.642 -176.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -167.0 143.84 4.58 Favored 'General case' 0 N--CA 1.448 -0.558 1 C-N-CA 132.299 4.24 . . . . 0.0 104.6 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.426 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 29.4 p90 -165.2 171.26 13.9 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 125.044 1.338 . . . . 0.0 107.447 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -132.72 123.53 49.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 O-C-N 121.558 -0.714 . . . . 0.0 109.533 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -128.07 136.64 51.49 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 125.515 1.526 . . . . 0.0 107.019 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.4 t70 52.45 34.95 16.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.272 1.429 . . . . 0.0 110.355 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 64.64 12.73 7.78 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.795 2.038 . . . . 0.0 112.593 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -106.38 138.08 43.2 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 126.216 1.807 . . . . 0.0 108.299 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -68.72 136.64 53.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.3 m-85 -144.9 159.27 43.17 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.976 0.911 . . . . 0.0 109.275 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -149.36 164.26 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.394 -0.816 . . . . 0.0 109.174 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 t -97.63 132.31 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.27 175.57 5.43 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.379 0.609 . . . . 0.0 109.729 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -77.06 -11.09 59.76 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.38 1.072 . . . . 0.0 113.208 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.19 110.97 5.48 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.211 1.004 . . . . 0.0 108.871 178.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -98.88 143.42 29.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.439 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -118.75 136.19 24.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.67 159.44 52.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.931 2.421 . . . . 0.0 112.905 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -61.83 -27.75 68.99 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -71.77 -22.67 61.56 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.946 0.794 . . . . 0.0 110.093 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -84.47 -24.7 29.35 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -64.81 147.07 12.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.42 HD21 ' HA ' ' A' ' 78' ' ' SER . 25.3 t-20 -112.08 -60.97 1.78 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.602 1.161 . . . . 0.0 110.937 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -153.93 168.01 27.82 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.391 0.676 . . . . 0.0 112.486 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 p -69.87 147.57 50.13 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 126.12 1.768 . . . . 0.0 109.196 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -119.25 -52.6 2.28 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 117.791 -1.1 . . . . 0.0 111.404 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 t -149.11 118.59 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 119.787 1.176 . . . . 0.0 112.598 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -86.03 101.45 12.94 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 177.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.49 158.23 34.99 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 128.834 2.854 . . . . 0.0 107.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -141.12 108.16 5.45 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 120.21 1.368 . . . . 0.0 111.984 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.757 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -148.13 138.58 22.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.325 -0.859 . . . . 0.0 110.432 178.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -130.76 145.08 51.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 127.467 2.307 . . . . 0.0 108.15 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.757 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -150.24 171.34 17.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.394 1.877 . . . . 0.0 109.03 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.0 mt -128.22 131.93 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 124.433 1.093 . . . . 0.0 108.104 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.59 130.21 74.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.296 1.038 . . . . 0.0 111.01 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.63 122.61 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 127.244 2.217 . . . . 0.0 110.109 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.0 mmm -69.25 -21.8 63.88 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -83.07 -53.26 5.94 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.495 1.118 . . . . 0.0 110.991 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.3 m -92.4 -11.01 36.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.105 -178.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 60.89 23.43 13.48 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 120.073 1.306 . . . . 0.0 110.766 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 mtpp -110.98 162.7 14.58 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.944 1.298 . . . . 0.0 111.371 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.621 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -74.98 146.57 41.57 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.29 0.636 . . . . 0.0 110.88 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.5 mt -135.22 174.98 10.01 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.87 1.668 . . . . 0.0 109.761 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.9 m -115.09 -8.65 12.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.607 1.163 . . . . 0.0 110.455 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.6 m -116.92 127.11 53.92 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.569 1.148 . . . . 0.0 113.086 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.1 t -80.13 99.23 7.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -121.41 166.84 13.52 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.369 0.668 . . . . 0.0 109.984 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -56.5 -36.78 69.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -87.73 18.53 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.065 0.546 . . . . 0.0 110.401 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.8 t -138.37 154.46 48.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 126.173 1.789 . . . . 0.0 108.678 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.64 139.87 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.052 0.941 . . . . 0.0 109.194 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.71 144.37 26.04 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.938 0.895 . . . . 0.0 109.543 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -136.15 150.47 49.07 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.013 1.325 . . . . 0.0 107.519 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 t -125.37 103.35 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.29 95.26 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -160.59 -174.82 4.65 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 44.81 68.95 0.48 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.73 2.012 . . . . 0.0 114.616 178.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.6 mt -68.9 145.36 13.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.679 1.192 . . . . 0.0 110.107 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -140.12 169.69 17.22 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 128.134 2.574 . . . . 0.0 110.414 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -115.78 163.68 15.48 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 127.781 2.432 . . . . 0.0 108.672 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -120.86 168.64 11.25 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.799 2.04 . . . . 0.0 109.994 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.42 ' HA ' HD21 ' A' ' 39' ' ' ASN . 9.2 t -57.3 -36.93 71.69 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.97 18.78 2.84 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.874 1.27 . . . . 0.0 111.403 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt 66.14 9.86 6.61 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.065 1.346 . . . . 0.0 112.261 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 t -73.92 137.92 43.95 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -100.18 150.46 22.49 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 122.974 0.51 . . . . 0.0 109.808 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.1 p -145.68 171.11 15.2 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.802 0.441 . . . . 0.0 112.117 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.9 ttm -137.18 142.17 42.17 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.1 1.76 . . . . 0.0 110.644 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.81 129.55 9.14 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 124.772 1.177 . . . . 0.0 110.824 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.9 mt -147.6 126.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 50.69 39.99 23.03 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.765 0.826 . . . . 0.0 110.396 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 63.54 15.55 8.93 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.975 2.11 . . . . 0.0 114.755 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -118.22 140.34 49.95 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 125.495 1.518 . . . . 0.0 107.388 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -91.33 116.15 28.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.903 -0.498 . . . . 0.0 110.81 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.28 127.25 53.38 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.975 1.31 . . . . 0.0 109.769 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.572 ' HE3' HD21 ' A' ' 94' ' ' LEU . 15.9 tttp -60.98 154.65 21.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.184 0.993 . . . . 0.0 110.216 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -120.24 132.66 69.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.572 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.1 mm? -120.42 155.47 56.36 Favored Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 124.486 1.114 . . . . 0.0 110.286 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.35 147.87 60.04 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.706 2.271 . . . . 0.0 107.864 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.11 -18.43 47.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.136 0.426 . . . . 0.0 111.919 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.6 t -67.51 -21.61 65.48 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 121.301 -0.875 . . . . 0.0 109.964 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -79.66 -3.11 45.79 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.119 0.968 . . . . 0.0 113.392 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -52.62 155.87 2.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.313 1.054 . . . . 0.0 109.571 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.85 -42.51 2.65 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.24 -32.47 24.44 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 p -137.7 162.37 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 C-N-CA 125.957 1.703 . . . . 0.0 108.955 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -136.31 170.61 15.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.922 2.489 . . . . 0.0 107.529 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.11 166.24 2.95 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.797 0.808 . . . . 0.0 110.699 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.614 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -65.15 171.9 3.39 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.177 0.591 . . . . 0.0 111.558 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.614 ' N ' HD12 ' A' ' 105' ' ' LEU . 61.9 mtm180 -127.29 136.29 51.76 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.722 0.809 . . . . 0.0 111.162 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.8 OUTLIER -67.32 -21.32 65.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 124.342 1.057 . . . . 0.0 112.2 -179.405 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -60.05 -10.85 4.72 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -81.9 -0.43 43.73 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.867 0.758 . . . . 0.0 109.81 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.245 0.839 0 C-N-CA 127.579 2.352 . . . . 0.0 107.914 -179.454 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -99.54 -176.99 3.44 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.19 1.396 . . . . 0.0 108.326 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -132.85 69.76 1.48 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 p -67.92 65.78 0.09 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.564 2.346 . . . . 0.0 111.931 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -136.62 2.59 2.69 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.518 1.927 . . . . 0.0 112.458 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.4 145.26 24.78 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 120.908 -1.12 . . . . 0.0 109.39 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.74 167.25 7.66 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 127.882 2.473 . . . . 0.0 111.583 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.8 t -132.96 130.62 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.7 ttm-85 -102.6 115.83 31.36 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -86.81 166.77 14.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -75.19 -33.04 61.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.933 0.788 . . . . 0.0 112.104 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 60.41 117.73 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.297 1.839 . . . . 0.0 114.295 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.63 18.96 78.54 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -137.94 178.04 7.42 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.938 1.695 . . . . 0.0 111.184 -178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -74.18 -168.38 0.63 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 128.707 2.803 . . . . 0.0 108.937 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.4 p -79.12 120.16 23.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.436 2.065 . . . . 0.0 107.849 -176.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -168.64 145.76 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 130.353 3.461 . . . . 0.0 105.941 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 39.4 p90 -165.21 174.91 9.75 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.215 2.206 . . . . 0.0 106.771 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 73.2 mt -135.44 128.28 47.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -137.09 140.63 42.09 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.2 t70 51.83 39.19 25.16 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.9 1.68 . . . . 0.0 112.489 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.61 16.78 10.66 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.629 1.572 . . . . 0.0 112.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -120.2 141.87 49.52 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.872 1.269 . . . . 0.0 110.08 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.9 m -72.33 127.42 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.691 1.597 . . . . 0.0 108.706 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -140.39 160.03 40.89 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.565 0.746 . . . . 0.0 112.34 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -148.8 162.57 39.53 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 121.21 -0.931 . . . . 0.0 111.189 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.2 t -92.23 127.55 44.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 124.097 0.959 . . . . 0.0 109.894 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.8 p -98.97 171.13 8.24 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.817 1.247 . . . . 0.0 109.863 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -81.17 -10.9 59.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.998 1.719 . . . . 0.0 112.598 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.29 111.5 5.94 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.552 1.941 . . . . 0.0 109.692 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.8 tt0 -95.96 146.36 24.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.309 1.444 . . . . 0.0 111.864 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.99 131.77 24.01 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.748 2.419 . . . . 0.0 107.253 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.95 156.28 47.82 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.591 2.86 . . . . 0.0 112.484 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -58.26 -26.6 63.12 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.085 0.954 . . . . 0.0 113.5 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.41 -26.21 63.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.317 0.508 . . . . 0.0 110.665 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -82.82 -25.33 32.79 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.56 118.2 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.014 0.925 . . . . 0.0 108.598 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -77.77 -61.04 2.12 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.049 0.94 . . . . 0.0 109.776 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -159.75 173.63 15.73 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.86 0.864 . . . . 0.0 109.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.423 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 70.0 m -62.91 171.36 2.2 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.024 1.33 . . . . 0.0 110.933 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -145.79 -45.03 0.21 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 120.559 -1.338 . . . . 0.0 113.746 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.2 t -152.44 132.88 4.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-N 118.983 0.811 . . . . 0.0 109.693 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -109.52 109.01 19.69 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.094 1.358 . . . . 0.0 107.782 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -139.39 157.41 45.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 127.894 2.478 . . . . 0.0 107.274 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -125.27 107.48 10.76 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.469 ' HE2' HD23 ' A' ' 49' ' ' LEU . 12.8 tptm -145.59 122.72 11.46 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.835 0.743 . . . . 0.0 109.332 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.4 tt -129.73 143.36 50.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 128.548 2.739 . . . . 0.0 106.575 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.469 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -152.23 170.54 19.77 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 126.047 1.739 . . . . 0.0 107.245 178.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.434 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.5 mt -129.22 132.02 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.1 t -121.98 136.16 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.047 1.339 . . . . 0.0 108.755 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -78.85 119.04 21.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 126.001 1.72 . . . . 0.0 109.301 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.9 mtp -68.44 -19.53 64.58 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 121.789 2.086 . . . . 0.0 111.531 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -38.27 69.08 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 117.914 -1.041 . . . . 0.0 113.638 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.3 p -121.98 -9.06 8.79 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 60.31 41.19 16.74 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 125.969 1.707 . . . . 0.0 111.024 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -122.47 158.26 30.15 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.902 1.281 . . . . 0.0 109.491 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.434 HD13 ' O ' ' A' ' 50' ' ' ILE . 4.3 mm? -71.02 146.95 49.07 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.02 0.528 . . . . 0.0 111.734 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.6 mt -132.64 158.17 42.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.704 1.602 . . . . 0.0 110.3 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -86.75 -21.84 26.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.524 0.73 . . . . 0.0 110.726 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -135.95 146.79 47.65 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.462 1.505 . . . . 0.0 111.246 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.64 98.85 11.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 127.595 2.358 . . . . 0.0 112.03 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -97.08 171.76 8.27 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.8 -0.563 . . . . 0.0 110.155 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -53.61 -21.89 7.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.697 2.399 . . . . 0.0 117.462 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -105.73 1.17 26.86 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.578 1.951 . . . . 0.0 110.675 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.7 t -114.69 161.83 17.62 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.974 1.71 . . . . 0.0 110.63 -177.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.2 t -138.55 126.46 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 124.612 1.165 . . . . 0.0 109.284 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.9 t -77.31 143.09 39.07 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.9 mt -130.21 145.41 51.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.38 103.69 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.26 93.03 6.66 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -166.31 -162.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 44.17 67.28 0.7 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.699 1.999 . . . . 0.0 111.482 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 mt -75.14 142.64 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.427 1.091 . . . . 0.0 110.105 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 73.6 m-85 -141.87 158.6 43.59 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -103.03 165.5 10.99 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.718 1.207 . . . . 0.0 110.104 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.24 169.99 12.31 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.733 0.813 . . . . 0.0 112.736 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -58.78 -41.1 85.88 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.245 1.418 . . . . 0.0 109.814 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.03 13.24 5.22 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.579 1.951 . . . . 0.0 109.797 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.46 10.98 5.23 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.85 2.06 . . . . 0.0 110.922 -177.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.2 m -65.41 149.58 49.76 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -111.32 140.23 46.06 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.13 175.2 9.82 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.818 0.847 . . . . 0.0 112.086 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.8 ttm -134.83 142.14 46.57 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.9 2.08 . . . . 0.0 108.967 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.65 125.78 8.09 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.953 -1.659 . . . . 0.0 108.953 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.2 mt -142.6 121.53 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 48.35 54.94 9.59 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.254 1.421 . . . . 0.0 113.51 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 69.25 -2.84 1.71 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.88 1.672 . . . . 0.0 114.712 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -112.78 156.7 22.41 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 125.129 1.372 . . . . 0.0 109.469 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.69 117.0 29.6 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.14 0.976 . . . . 0.0 109.396 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.76 133.64 52.91 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.269 1.428 . . . . 0.0 112.175 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HE3' HD21 ' A' ' 94' ' ' LEU . 13.2 ttpt -63.1 145.07 56.25 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.757 0.823 . . . . 0.0 110.877 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -110.36 132.63 58.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.482 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.4 mm? -126.46 156.32 73.07 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.19 161.8 42.18 Favored 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 122.247 1.965 . . . . 0.0 111.057 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -21.25 66.46 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.56 -6.04 37.77 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.024 1.33 . . . . 0.0 112.579 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.33 -3.94 36.05 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.374 0.988 . . . . 0.0 111.69 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 20.1 mmtm -54.47 156.96 3.06 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-N 119.596 1.089 . . . . 0.0 111.873 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 108.49 -42.81 1.85 Allowed Glycine 0 CA--C 1.521 0.464 0 N-CA-C 108.396 -1.882 . . . . 0.0 108.396 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.37 -42.25 8.99 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.1 159.96 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 125.617 1.567 . . . . 0.0 110.77 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -143.07 173.29 11.7 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.694 2.798 . . . . 0.0 107.0 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.6 164.88 4.18 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.655 1.182 . . . . 0.0 110.359 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 172.96 3.89 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -116.97 127.39 54.15 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 125.385 1.474 . . . . 0.0 108.655 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.518 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -64.93 -20.17 66.32 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.578 0.751 . . . . 0.0 111.121 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -55.04 -24.86 26.91 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.54 1.536 . . . . 0.0 111.782 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -68.86 -16.0 63.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.495 -0.753 . . . . 0.0 110.416 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 125.999 1.72 . . . . 0.0 109.789 -178.98 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -133.15 178.87 6.57 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 119.759 -1.838 . . . . 0.0 107.813 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.6 t -154.76 163.01 40.87 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.342 -0.849 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.9 t -111.25 90.48 3.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 126.217 1.807 . . . . 0.0 106.255 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -57.41 122.41 12.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.541 1.136 . . . . 0.0 108.927 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -139.31 168.18 20.42 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.003 1.321 . . . . 0.0 110.373 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -65.12 133.71 52.17 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 178.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.43 135.89 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.1 ttt-85 -107.91 98.52 8.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -82.24 148.92 28.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.55 -33.73 73.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 117.885 -1.055 . . . . 0.0 112.686 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 79.06 131.07 0.05 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 129.7 3.2 . . . . 0.0 114.281 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.41 34.49 54.64 Favored Glycine 0 CA--C 1.522 0.501 0 C-N-CA 126.088 1.804 . . . . 0.0 111.196 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.9 p -137.83 178.48 7.08 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 110.575 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.78 -170.08 0.65 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.891 2.076 . . . . 0.0 109.328 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.3 p -79.6 120.22 23.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 123.927 1.822 . . . . 0.0 108.535 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -167.44 149.95 5.98 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 130.976 3.71 . . . . 0.0 105.014 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 42.7 p90 -172.88 175.86 3.22 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.4 mt -134.56 130.94 53.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -130.61 138.15 49.97 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.6 t0 47.57 42.97 15.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.747 1.619 . . . . 0.0 113.832 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 61.0 22.51 12.75 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 0.0 112.877 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -122.9 128.64 50.6 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.222 1.809 . . . . 0.0 106.623 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 71.2 m -74.75 132.25 41.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -130.35 166.28 20.75 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 127.013 2.125 . . . . 0.0 110.348 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -148.54 166.35 28.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -99.63 126.93 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.2 p -93.26 171.18 9.08 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.896 0.878 . . . . 0.0 110.291 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -77.86 -15.67 58.87 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.463 1.505 . . . . 0.0 111.53 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.8 122.77 18.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.991 1.317 . . . . 0.0 110.618 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 32.6 tt0 -111.0 145.68 38.02 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.227 1.411 . . . . 0.0 110.394 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -115.64 141.23 27.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.651 1.18 . . . . 0.0 108.654 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.99 152.15 51.19 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.208 2.605 . . . . 0.0 110.352 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.55 -33.04 63.5 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -64.56 -20.8 66.46 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -90.97 -15.38 29.81 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.566 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.2 t -70.9 123.75 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.906 0.882 . . . . 0.0 108.623 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -75.67 -62.04 1.72 Allowed 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.87 173.01 14.27 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.135 0.88 . . . . 0.0 110.825 178.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.5 p -65.34 135.78 55.72 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 125.49 1.516 . . . . 0.0 110.206 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.98 -49.39 3.14 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 116.996 -1.478 . . . . 0.0 112.656 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.8 t -143.92 122.01 6.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 120.185 1.357 . . . . 0.0 112.052 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -83.05 114.31 21.2 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.11 158.84 44.58 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 127.828 2.451 . . . . 0.0 109.623 -178.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -143.44 119.75 10.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.011 0.924 . . . . 0.0 109.434 178.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' HE3' HD23 ' A' ' 49' ' ' LEU . 3.0 tmtm? -148.08 136.61 21.57 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -133.59 144.71 49.46 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.338 1.855 . . . . 0.0 109.072 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.438 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -156.3 169.67 24.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.016 1.327 . . . . 0.0 109.551 177.732 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.9 mt -126.43 136.0 62.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 125.492 1.517 . . . . 0.0 107.898 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.2 t -134.82 134.25 53.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 125.911 1.684 . . . . 0.0 109.991 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -72.13 116.81 12.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 127.917 2.487 . . . . 0.0 111.699 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.7 mtp -68.24 -18.28 64.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.128 0.876 . . . . 0.0 112.176 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -66.43 -53.78 31.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.818 1.19 . . . . 0.0 111.372 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.7 m -122.6 8.61 9.53 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 59.44 47.09 11.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.227 1.811 . . . . 0.0 112.939 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -116.64 147.17 42.17 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.368 1.067 . . . . 0.0 108.883 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mp -69.52 155.8 39.9 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.36 157.81 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.723 1.209 . . . . 0.0 110.465 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.9 p -88.1 -12.44 44.13 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.285 -1.34 . . . . 0.0 114.194 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 p -147.66 148.99 31.64 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 121.136 1.789 . . . . 0.0 112.31 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -69.77 116.97 10.77 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.862 1.265 . . . . 0.0 109.393 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -137.43 156.64 47.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.18 1.392 . . . . 0.0 109.806 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -54.44 -31.64 55.84 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -80.39 3.57 20.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.322 0.965 . . . . 0.0 111.311 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -124.47 177.01 6.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.934 1.694 . . . . 0.0 111.616 -177.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.0 t -142.46 150.28 18.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 127.959 2.503 . . . . 0.0 105.831 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.8 t -102.61 140.63 36.63 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.32 144.84 50.3 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 t -115.9 103.32 15.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.87 94.37 8.9 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.361 -1.462 . . . . 0.0 107.39 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -164.25 -173.76 3.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -177.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 46.45 69.46 0.48 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.335 1.854 . . . . 0.0 114.815 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.3 mt -70.01 143.87 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.53 169.39 17.87 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.775 2.03 . . . . 0.0 108.833 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -117.96 154.13 32.46 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.28 161.07 16.4 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.526 1.13 . . . . 0.0 110.009 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -65.78 -13.36 59.27 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.274 0.63 . . . . 0.0 111.421 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 2.89 56.41 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.224 1.41 . . . . 0.0 109.472 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm 79.6 -1.59 2.16 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 129.157 2.983 . . . . 0.0 112.11 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.5 m -77.35 162.38 27.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 120.55 1.523 . . . . 0.0 108.099 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.17 158.43 17.44 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.224 1.01 . . . . 0.0 109.639 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.3 p -149.32 172.79 14.32 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.037 0.835 . . . . 0.0 109.522 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.3 ttm -136.03 135.85 39.77 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.789 1.636 . . . . 0.0 108.449 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.26 109.88 3.12 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 74.9 mt -123.03 123.81 68.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.9 m120 51.7 37.91 21.41 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.794 1.237 . . . . 0.0 109.609 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 69.24 16.31 8.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.89 2.876 . . . . 0.0 114.554 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -117.17 132.75 56.58 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -86.5 115.92 24.3 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.569 -0.707 . . . . 0.0 110.252 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 76.4 m-85 -110.21 128.27 55.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.861 1.265 . . . . 0.0 111.295 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.94 144.63 52.76 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.037 0.935 . . . . 0.0 110.315 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.57 132.91 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.36 156.48 57.78 Favored Pre-proline 0 N--CA 1.467 0.384 0 C-N-CA 124.457 1.103 . . . . 0.0 108.658 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -75.12 156.41 42.47 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.23 1.953 . . . . 0.0 108.505 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -65.5 -11.18 41.03 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.464 -0.773 . . . . 0.0 110.958 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -21.93 63.81 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.166 -0.959 . . . . 0.0 109.503 177.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.9 -7.39 59.6 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.483 1.113 . . . . 0.0 111.823 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -56.07 149.33 15.84 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 107.87 -32.05 7.43 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -178.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.97 -8.97 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.416 1.486 . . . . 0.0 111.887 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -150.54 150.2 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 C-N-CA 126.404 1.882 . . . . 0.0 107.13 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -131.06 169.67 15.55 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.765 1.626 . . . . 0.0 107.994 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.65 163.4 11.44 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.126 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.35 167.65 10.16 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt85 -110.36 135.67 50.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 126.148 1.779 . . . . 0.0 110.753 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -68.77 -15.58 63.55 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -59.03 -23.02 61.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.186 1.794 . . . . 0.0 111.441 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.5 m-20 -73.57 -6.02 43.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 118.341 -0.837 . . . . 0.0 111.981 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.565 1.546 . . . . 0.0 111.755 -177.822 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -109.05 131.15 55.35 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 -53.77 9.55 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.77 1.628 . . . . 0.0 113.157 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.9 t -52.33 124.54 13.56 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.684 1.993 . . . . 0.0 113.751 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -135.66 129.88 33.44 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 126.788 2.035 . . . . 0.0 108.16 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -147.4 156.39 42.83 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.097 2.159 . . . . 0.0 108.396 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -60.66 163.52 5.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.539 1.063 . . . . 0.0 110.161 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.3 t -110.12 130.55 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -89.15 116.97 27.8 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -85.08 153.3 22.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -59.66 -34.34 72.71 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 128.109 2.564 . . . . 0.0 113.96 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 59.66 103.64 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 127.944 2.498 . . . . 0.0 113.704 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' HA2' ' CD2' ' A' ' 58' ' ' LEU . . . 69.93 31.84 69.84 Favored Glycine 0 CA--C 1.528 0.88 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.279 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -134.71 179.88 6.02 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.397 1.879 . . . . 0.0 112.659 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.53 -168.59 0.45 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.155 2.582 . . . . 0.0 107.502 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -78.46 120.37 23.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 116.993 -1.883 . . . . 0.0 108.295 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -168.06 146.68 4.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 128.949 2.899 . . . . 0.0 107.808 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -170.87 177.05 3.92 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.321 0.964 . . . . 0.0 109.429 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 44.1 mt -135.65 126.28 43.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 121.446 -0.784 . . . . 0.0 109.031 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -129.86 134.24 47.4 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 105.576 -2.009 . . . . 0.0 105.576 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.8 t0 53.15 38.09 26.64 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.255 1.022 . . . . 0.0 112.49 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 m120 62.57 16.02 8.43 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.482 2.313 . . . . 0.0 113.112 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -111.4 136.95 49.82 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.46 1.104 . . . . 0.0 108.796 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -71.55 122.24 20.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.449 1.5 . . . . 0.0 107.611 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -134.48 162.33 32.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.181 1.393 . . . . 0.0 109.957 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -149.27 171.89 15.76 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.397 1.079 . . . . 0.0 108.527 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 t -100.82 125.26 54.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.5 p -96.52 170.47 9.19 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.521 1.129 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -77.72 -9.44 59.0 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.185 1.794 . . . . 0.0 112.961 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -70.19 97.46 1.21 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.858 1.263 . . . . 0.0 108.523 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -89.14 145.1 25.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 123.655 0.782 . . . . 0.0 109.672 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.95 142.77 33.91 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 126.514 1.926 . . . . 0.0 112.399 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.79 146.82 30.35 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 123.836 3.024 . . . . 0.0 109.728 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -53.99 -31.52 51.2 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.741 1.216 . . . . 0.0 113.874 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.72 -29.06 69.53 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.317 -0.864 . . . . 0.0 111.1 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -84.58 -15.46 45.57 Favored 'General case' 0 C--O 1.23 0.053 0 O-C-N 121.157 -0.964 . . . . 0.0 109.109 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 ' CD2' ' A' ' 90' ' ' TYR . 95.4 t -77.18 114.04 17.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 178.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 -68.09 -61.26 1.94 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 124.915 1.286 . . . . 0.0 109.5 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.2 169.47 20.71 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.402 1.001 . . . . 0.0 110.502 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 p -71.58 151.72 43.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD12 ' A' ' 82' ' ' LEU . 3.8 ttmt -118.58 -38.78 3.08 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.492 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 t -147.57 140.87 19.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 118.548 0.613 . . . . 0.0 111.905 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -113.88 93.95 4.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 125.596 1.558 . . . . 0.0 107.875 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -140.24 156.46 46.48 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 128.35 2.66 . . . . 0.0 105.549 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -131.01 126.49 36.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.291 1.836 . . . . 0.0 108.709 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE3' HD23 ' A' ' 71' ' ' LEU . 0.6 OUTLIER -147.37 129.99 15.96 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.454 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 tt -134.55 144.51 48.03 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.977 1.711 . . . . 0.0 108.175 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.45 169.88 23.6 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 125.918 1.687 . . . . 0.0 107.8 178.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -128.01 134.71 64.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 119.56 1.073 . . . . 0.0 108.343 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.63 133.68 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 125.061 1.344 . . . . 0.0 110.617 -178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -71.69 119.3 15.65 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.858 2.063 . . . . 0.0 108.506 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.1 mtp -68.72 -17.34 64.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.871 0.76 . . . . 0.0 112.684 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.468 ' HE2' ' HA ' ' A' ' 54' ' ' LYS . 7.4 mmpt? -79.81 -53.93 6.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.302 1.41 . . . . 0.0 112.47 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.6 m -97.31 -7.72 31.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 66.31 14.91 9.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.018 1.727 . . . . 0.0 110.846 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -99.11 155.25 17.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 125.631 1.572 . . . . 0.0 111.454 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.409 ' CD2' ' HA2' ' A' ' 14' ' ' GLY . 5.5 mp -74.0 157.46 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 177.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.7 mt -126.68 -174.4 3.12 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.794 1.238 . . . . 0.0 112.091 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -13.77 15.92 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.465 1.906 . . . . 0.0 113.525 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 p -149.37 -172.41 4.13 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.615 1.166 . . . . 0.0 108.505 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.5 t -113.86 106.82 14.9 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -109.41 164.41 12.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 125.187 1.395 . . . . 0.0 109.061 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -10.96 6.04 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.682 1.593 . . . . 0.0 114.732 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.03 14.71 20.81 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.583 1.083 . . . . 0.0 109.001 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 t -131.87 167.18 20.04 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.51 1.524 . . . . 0.0 109.898 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -140.87 135.23 33.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 125.215 1.406 . . . . 0.0 109.0 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 t -79.43 142.9 35.5 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.8 mt -132.85 133.16 42.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -113.16 103.44 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 103.228 -2.879 . . . . 0.0 103.228 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.504 HD23 ' HE3' ' A' ' 47' ' ' LYS . 1.9 mm? -97.93 91.89 5.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 -178.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -164.87 -163.76 0.74 Allowed 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 54.13 67.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.963 0.887 . . . . 0.0 112.109 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.7 mt -80.79 133.71 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.346 -0.846 . . . . 0.0 110.239 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -133.39 169.71 16.54 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.566 1.946 . . . . 0.0 110.093 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -117.66 150.31 39.26 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.881 2.072 . . . . 0.0 109.745 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.99 168.49 9.02 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 126.86 2.064 . . . . 0.0 110.214 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.5 m -53.85 -37.95 64.17 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.242 1.017 . . . . 0.0 113.449 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -85.76 11.91 10.1 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 126.136 1.775 . . . . 0.0 113.211 -177.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.7 mptt 74.73 1.21 3.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.921 1.689 . . . . 0.0 110.223 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.8 t -71.21 152.33 43.45 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 104.821 -2.288 . . . . 0.0 104.821 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -109.28 153.17 24.25 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.628 0.771 . . . . 0.0 109.744 -178.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.6 p -139.62 168.33 20.06 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.517 1.127 . . . . 0.0 109.647 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.9 ttm -133.83 138.35 45.6 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.075 1.75 . . . . 0.0 109.703 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.27 118.84 4.71 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 127.279 2.371 . . . . 0.0 111.184 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.7 mt -137.0 119.66 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 51.48 44.21 29.15 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.625 0.77 . . . . 0.0 109.264 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 56.6 m-20 62.41 17.83 9.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.054 2.142 . . . . 0.0 114.676 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -118.48 131.27 56.25 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 124.371 1.068 . . . . 0.0 109.113 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.409 ' CD2' HG21 ' A' ' 38' ' ' VAL . 14.2 m-85 -86.74 116.29 24.74 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 122.338 0.255 . . . . 0.0 111.031 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -109.08 123.63 49.48 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.272 2.229 . . . . 0.0 109.547 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -59.92 142.38 53.77 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.725 1.61 . . . . 0.0 111.289 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -110.45 133.66 55.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -129.36 163.42 46.45 Favored Pre-proline 0 N--CA 1.468 0.459 0 C-N-CA 125.886 1.675 . . . . 0.0 110.999 -177.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.59 152.22 37.82 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.68 2.253 . . . . 0.0 111.084 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.4 -6.34 4.72 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -15.44 59.69 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.63 -1.293 . . . . 0.0 110.929 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -73.01 -4.25 31.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -45.71 138.76 4.45 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 127.15 2.18 . . . . 0.0 111.06 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 101.77 -26.81 23.1 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.92 -18.62 8.16 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.402 1.081 . . . . 0.0 111.985 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -140.74 157.11 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -145.93 167.44 23.28 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 127.039 2.135 . . . . 0.0 107.767 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.18 162.46 5.86 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.258 0.623 . . . . 0.0 110.561 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.98 168.64 13.3 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.891 -0.506 . . . . 0.0 111.502 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -111.7 139.72 46.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.972 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.3 mp -68.82 -13.35 62.36 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 123.836 0.854 . . . . 0.0 111.019 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -60.27 -23.04 63.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.174 0.99 . . . . 0.0 111.943 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -71.47 -7.48 47.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.341 1.056 . . . . 0.0 110.99 -177.114 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 14.8 p90 . . . . . 0 N--CA 1.471 0.602 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 51.39 32.32 8.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.02 1.328 . . . . 0.0 111.799 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.4 p -71.27 171.06 11.77 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.522 1.929 . . . . 0.0 111.896 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.0 m -146.54 -31.71 0.34 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.555 1.542 . . . . 0.0 112.099 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.8 t60 53.83 15.87 0.92 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.515 1.526 . . . . 0.0 112.757 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -62.07 134.61 56.82 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.739 1.616 . . . . 0.0 109.624 -179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.48 157.59 37.76 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.734 1.213 . . . . 0.0 108.984 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.403 HG21 HD12 ' A' ' 74' ' ' ILE . 84.8 t -112.23 144.7 19.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -119.44 96.93 5.41 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -76.22 155.09 34.74 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.197 -2.149 . . . . 0.0 105.197 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -62.39 -33.33 74.55 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 74.41 123.95 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.919 2.088 . . . . 0.0 110.431 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.83 35.07 38.5 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.466 1.031 . . . . 0.0 113.533 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -140.17 -179.65 6.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.172 2.589 . . . . 0.0 109.335 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -72.67 -168.35 0.44 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.287 2.235 . . . . 0.0 111.27 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.277 22.0 p -79.21 118.18 20.91 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -176.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -169.28 140.5 2.36 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 126.781 2.032 . . . . 0.0 108.218 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.478 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.9 p90 -160.68 169.61 22.49 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.22 126.65 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 107.661 -1.236 . . . . 0.0 107.661 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -138.43 136.1 35.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.2 t0 55.16 41.39 31.59 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.011 1.325 . . . . 0.0 112.271 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 59.77 28.16 17.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.507 1.523 . . . . 0.0 111.644 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -130.95 142.76 50.38 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.403 1.081 . . . . 0.0 110.993 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.1 m -70.19 126.59 30.11 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.366 1.866 . . . . 0.0 107.767 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.478 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 5.5 m-85 -137.57 160.23 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.996 0.918 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.46 ' CE2' HG22 ' A' ' 29' ' ' THR . 21.8 p90 -149.63 165.29 32.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.998 0.919 . . . . 0.0 109.007 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' ILE . 41.5 t -94.65 128.64 45.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.916 -0.49 . . . . 0.0 109.779 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 27' ' ' PHE . 17.6 p -96.27 166.47 11.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.001 1.32 . . . . 0.0 111.962 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -76.87 -10.03 59.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.021 1.328 . . . . 0.0 112.443 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -71.69 98.94 2.02 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.396 1.479 . . . . 0.0 108.038 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -89.98 142.92 27.24 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.12 140.87 26.2 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.963 1.705 . . . . 0.0 107.966 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.26 149.18 50.91 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.247 1.965 . . . . 0.0 109.909 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -57.71 -23.55 52.35 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -73.14 -23.67 60.5 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.931 -0.481 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -87.47 -14.82 39.4 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.654 1.182 . . . . 0.0 109.976 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.98 122.73 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -73.21 -61.51 1.79 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.5 p-10 -167.09 168.35 13.72 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.931 1.292 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.1 p -65.14 160.36 21.41 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HE3' HD12 ' A' ' 82' ' ' LEU . 20.5 ttmm -128.21 -50.01 1.31 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 117.492 -1.242 . . . . 0.0 111.347 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -143.2 136.65 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 120.021 1.282 . . . . 0.0 111.691 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mtmm -104.24 114.83 29.34 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.613 1.965 . . . . 0.0 109.201 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -146.8 157.91 43.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 127.613 2.365 . . . . 0.0 108.988 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 108.29 5.65 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.274 0.943 . . . . 0.0 110.58 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.19 142.24 27.08 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.8 tt -135.15 145.27 47.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 127.979 2.512 . . . . 0.0 109.382 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.48 170.37 17.0 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.89 1.676 . . . . 0.0 108.755 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.98 136.73 59.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 125.49 1.516 . . . . 0.0 108.621 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -137.19 134.77 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.285 0.634 . . . . 0.0 109.956 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.587 ' HB2' HD11 ' A' ' 59' ' ' LEU . 11.4 t0 -79.81 125.35 29.59 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.403 1.081 . . . . 0.0 108.458 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 81.7 mtp -65.94 -16.22 63.67 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.965 1.257 . . . . 0.0 112.934 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -63.36 -53.79 47.03 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.094 0.861 . . . . 0.0 111.719 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 t -122.69 9.44 9.54 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 56.53 38.21 29.45 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.767 1.167 . . . . 0.0 110.085 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -105.86 143.03 34.58 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 125.223 1.409 . . . . 0.0 108.676 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.72 153.72 41.03 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.819 0.818 . . . . 0.0 111.092 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.587 HD11 ' HB2' ' A' ' 52' ' ' ASP . 31.7 mt -135.25 157.6 46.49 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.629 -1.168 . . . . 0.0 110.803 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.24 -20.88 33.7 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.815 1.246 . . . . 0.0 110.973 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 m -149.22 140.32 23.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.077 0.951 . . . . 0.0 108.454 -178.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.64 119.0 19.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.551 1.54 . . . . 0.0 110.404 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -107.28 172.0 7.07 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 126.329 1.852 . . . . 0.0 107.438 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -56.74 -26.45 57.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.717 1.376 . . . . 0.0 114.717 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -92.86 4.17 54.36 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.491 0.716 . . . . 0.0 111.754 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 43.0 t -117.62 166.69 12.1 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.569 1.548 . . . . 0.0 113.314 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.5 t -137.53 148.25 25.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 127.046 2.139 . . . . 0.0 106.545 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -101.91 143.4 31.85 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -130.86 136.82 49.0 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 t -116.04 101.96 12.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.72 96.7 9.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.915 1.286 . . . . 0.0 107.957 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.58 -161.76 0.25 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 118.41 0.55 . . . . 0.0 112.398 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.8 t30 52.42 66.76 1.12 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.639 1.976 . . . . 0.0 112.281 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.403 HD12 HG21 ' A' ' 9' ' ' VAL . 2.3 mt -81.55 135.12 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.184 -0.948 . . . . 0.0 111.277 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -139.36 161.97 36.15 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.637 1.975 . . . . 0.0 109.729 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -104.67 155.43 18.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.517 1.527 . . . . 0.0 108.606 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.59 163.92 12.82 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.419 1.887 . . . . 0.0 109.75 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.1 p -57.76 -34.2 69.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.378 0.671 . . . . 0.0 112.809 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -80.55 11.63 3.62 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.038 0.935 . . . . 0.0 110.582 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 71.19 12.04 6.83 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 127.878 2.471 . . . . 0.0 110.29 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.13 167.14 20.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.433 HD12 ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -119.12 148.4 43.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.637 1.175 . . . . 0.0 109.553 -178.235 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 17.5 p -147.2 167.23 24.72 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.476 0.71 . . . . 0.0 110.161 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.4 ttm -133.85 137.55 45.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 126.313 1.845 . . . . 0.0 108.198 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.54 121.2 5.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 125.298 1.428 . . . . 0.0 109.82 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.0 mt -136.72 120.62 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 51.42 51.22 17.26 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.586 1.954 . . . . 0.0 110.103 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t0 59.86 15.89 5.26 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.015 1.726 . . . . 0.0 114.134 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -121.09 139.18 53.67 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 125.266 1.426 . . . . 0.0 109.389 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -96.72 116.43 29.12 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 118.331 0.514 . . . . 0.0 111.391 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -106.89 125.84 51.53 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.26 1.424 . . . . 0.0 109.491 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -60.71 146.32 46.22 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.155 0.982 . . . . 0.0 109.697 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 28' ' ' VAL . 1.3 pt -115.9 132.93 63.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -129.19 165.16 34.34 Favored Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 124.713 1.205 . . . . 0.0 112.33 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.96 148.81 32.14 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.819 2.346 . . . . 0.0 110.176 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -58.65 -15.32 11.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.404 0.682 . . . . 0.0 112.703 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.2 m -72.66 -14.91 61.69 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 120.762 -1.211 . . . . 0.0 112.055 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.42 -4.07 43.48 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.799 -1.188 . . . . 0.0 111.445 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -53.96 150.24 8.07 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.994 1.318 . . . . 0.0 108.941 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.6 1.81 63.7 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -148.86 -49.89 0.15 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.018 2.527 . . . . 0.0 106.259 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 t -109.3 161.51 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.152 0.981 . . . . 0.0 109.068 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -150.67 170.51 19.01 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 127.097 2.159 . . . . 0.0 108.864 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.62 169.11 2.54 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.203 1.001 . . . . 0.0 112.174 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.31 174.94 9.57 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.587 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.1 mtt85 -125.12 141.69 51.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 O-C-N 121.887 -0.508 . . . . 0.0 110.79 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.579 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.4 OUTLIER -63.12 -22.04 66.59 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.312 1.045 . . . . 0.0 110.936 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -57.29 -16.57 8.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -76.77 -3.11 36.52 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.336 0.655 . . . . 0.0 110.495 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.253 1.252 0 C-N-CA 127.719 2.408 . . . . 0.0 107.729 -178.987 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 30.8 t80 . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -91.12 167.48 12.33 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.217 1.372 . . . . 0.0 109.958 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.6 p -138.24 -13.82 1.35 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.105 1.362 . . . . 0.0 112.573 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.8 m -81.38 151.8 27.77 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.71 1.204 . . . . 0.0 110.457 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -135.05 158.42 44.4 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.985 1.714 . . . . 0.0 106.664 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -139.36 153.76 47.73 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.093 1.357 . . . . 0.0 108.668 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? -67.54 137.23 55.58 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -104.07 130.45 54.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -98.23 111.94 24.09 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -87.04 158.88 19.13 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.85 -33.93 75.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 75.2 128.11 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.352 2.261 . . . . 0.0 112.348 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.99 34.83 39.32 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 125.737 1.637 . . . . 0.0 112.249 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.9 m -139.89 178.47 7.23 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 125.928 1.691 . . . . 0.0 112.096 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -73.65 -169.45 0.7 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.116 1.767 . . . . 0.0 108.764 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.6 p -79.67 120.88 24.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 119.658 -1.901 . . . . 0.0 110.574 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -168.23 144.41 3.84 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 130.172 3.389 . . . . 0.0 106.596 178.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 31.7 p90 -165.79 165.43 18.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.5 mp -120.57 131.3 73.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 123.784 0.834 . . . . 0.0 109.148 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -144.45 143.91 31.12 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 50.64 34.31 9.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 112.638 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 58.01 33.52 23.28 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 112.384 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -130.61 146.3 52.09 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.062 1.745 . . . . 0.0 106.864 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 m -74.44 140.81 44.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.8 m-85 -139.54 159.23 42.65 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 125.643 1.577 . . . . 0.0 109.523 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -148.91 165.69 30.8 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.021 -1.05 . . . . 0.0 109.799 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.9 t -101.26 128.24 53.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 p -99.71 172.39 7.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.356 1.462 . . . . 0.0 109.05 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -78.05 -15.58 58.79 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.624 1.97 . . . . 0.0 112.273 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -67.31 116.33 7.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.514 1.126 . . . . 0.0 110.681 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.24 148.26 23.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.969 1.708 . . . . 0.0 111.47 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.489 HD11 ' CD ' ' A' ' 92' ' ' LYS . 23.6 mm -116.4 127.77 26.5 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 126.594 1.958 . . . . 0.0 109.419 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.63 146.74 68.25 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.7 2.267 . . . . 0.0 109.477 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -55.93 -27.64 53.2 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.6 -23.78 67.52 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.535 0.734 . . . . 0.0 111.574 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -95.12 -19.07 20.41 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.63 139.21 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -93.36 -60.94 1.66 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.258 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -163.43 166.04 23.22 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.65 0.78 . . . . 0.0 111.668 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 p -70.76 126.74 30.42 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -101.51 -42.16 6.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 55.3 t -142.64 127.95 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 119.105 0.866 . . . . 0.0 108.877 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -100.38 117.37 34.43 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -149.93 157.08 42.82 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 131.282 3.833 . . . . 0.0 105.197 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -137.21 115.39 11.67 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 104.052 -2.574 . . . . 0.0 104.052 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -146.77 133.52 20.01 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.6 tt -137.58 145.63 43.08 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.876 1.67 . . . . 0.0 108.215 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.88 169.31 25.06 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 125.909 1.683 . . . . 0.0 106.48 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.5 mt -127.97 137.41 57.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 C-N-CA 125.617 1.567 . . . . 0.0 107.111 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -130.55 140.22 49.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.71 126.98 33.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 84.2 mtp -67.62 -18.69 65.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -72.22 -44.61 62.67 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -122.13 0.84 9.68 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.61 30.28 18.56 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.885 1.274 . . . . 0.0 111.068 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -99.05 147.05 25.43 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.88 0.872 . . . . 0.0 110.0 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.91 146.95 43.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mp -124.43 177.58 5.83 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.379 1.472 . . . . 0.0 110.397 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 t -116.9 -3.25 11.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.978 1.311 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 p -144.7 162.34 36.96 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 120.219 1.372 . . . . 0.0 109.129 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.8 t -92.76 115.4 28.08 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -124.44 161.59 25.71 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -56.45 -19.93 17.49 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -93.08 -4.33 52.58 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.92 0.888 . . . . 0.0 110.753 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 m -113.7 160.09 19.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.484 1.514 . . . . 0.0 113.771 -176.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 25.3 t -137.07 146.59 27.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 125.191 1.397 . . . . 0.0 108.826 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -85.75 141.37 29.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -129.98 100.75 5.56 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 105.887 -1.894 . . . . 0.0 105.887 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.87 102.41 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 103.203 -2.888 . . . . 0.0 103.203 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.32 93.71 8.35 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -164.37 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.656 -0.418 . . . . 0.0 112.005 -176.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 47.1 67.38 0.8 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.012 1.725 . . . . 0.0 111.723 177.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.2 mt -77.45 140.12 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.538 -1.351 . . . . 0.0 109.591 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -134.15 169.67 16.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.753 2.021 . . . . 0.0 111.01 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -113.06 170.8 7.95 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.017 2.127 . . . . 0.0 109.601 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.61 161.24 26.67 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.747 2.019 . . . . 0.0 108.272 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -60.57 -26.88 67.27 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.504 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -93.53 28.49 2.27 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.49 1.916 . . . . 0.0 111.32 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 59.35 3.19 0.36 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.328 1.851 . . . . 0.0 112.93 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.7 m -73.49 152.86 40.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.49 150.09 35.37 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.297 0.639 . . . . 0.0 110.773 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.0 p -144.69 169.44 18.0 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.901 0.88 . . . . 0.0 110.619 178.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.0 ttm -134.46 136.24 43.06 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 126.391 1.876 . . . . 0.0 109.328 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.48 110.38 3.28 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 125.502 1.525 . . . . 0.0 111.439 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.2 mt -123.68 119.16 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 49.49 51.81 15.69 Favored 'General case' 0 C--O 1.23 0.076 0 C-N-CA 124.689 1.195 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 70.31 -6.22 1.2 Allowed 'General case' 0 C--O 1.24 0.561 0 C-N-CA 128.046 2.538 . . . . 0.0 115.525 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -105.41 133.74 49.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.396 1.453 . . . . 0.0 110.646 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -85.67 116.66 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.455 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -115.85 132.53 56.61 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.504 1.122 . . . . 0.0 112.219 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.587 ' HE3' HD21 ' A' ' 94' ' ' LEU . 2.2 mtpp -60.53 142.38 55.41 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.833 1.253 . . . . 0.0 111.19 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.7 135.5 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.587 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.0 mm? -130.18 159.3 71.01 Favored Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 123.954 0.902 . . . . 0.0 108.818 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.0 161.18 45.32 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.312 2.008 . . . . 0.0 109.831 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.17 -13.07 32.77 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 110.472 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -63.34 -24.36 67.82 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.216 1.806 . . . . 0.0 109.555 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -10.69 59.99 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.828 1.251 . . . . 0.0 111.183 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.9 mmtt -59.26 161.49 5.42 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 120.682 -1.261 . . . . 0.0 109.941 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.7 -35.11 4.18 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -124.15 -5.92 7.81 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.3 t -135.51 156.81 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 126.515 1.926 . . . . 0.0 105.863 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -138.6 165.45 26.87 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.892 1.677 . . . . 0.0 108.131 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.88 166.42 15.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.02 167.31 10.04 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -106.89 132.29 53.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 125.886 1.674 . . . . 0.0 110.474 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mt -67.38 -21.41 65.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.311 0.644 . . . . 0.0 109.984 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -60.07 -20.42 58.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.901 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -67.09 -16.93 64.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.97 0.804 . . . . 0.0 112.293 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.691 1.996 . . . . 0.0 111.33 -177.387 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -130.32 151.6 50.65 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.202 0.601 . . . . 0.0 109.925 179.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.8 t -128.24 -6.9 5.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.71 166.7 5.16 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-N 118.943 0.792 . . . . 0.0 109.539 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -49.31 156.17 0.62 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -127.86 8.58 6.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.433 1.493 . . . . 0.0 111.832 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -60.13 128.16 35.44 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.7 t -64.44 143.71 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 O-C-N 121.825 -0.547 . . . . 0.0 110.183 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -117.12 105.6 12.44 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -84.63 153.61 23.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -67.18 -33.96 76.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.571 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 63.31 135.62 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.93 3.292 . . . . 0.0 112.408 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.95 24.35 74.4 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m -138.83 178.64 7.01 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.706 2.002 . . . . 0.0 112.286 -178.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.44 -169.02 0.6 Allowed 'General case' 0 C--O 1.24 0.599 0 C-N-CA 129.096 2.958 . . . . 0.0 107.694 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.258 35.2 p -79.32 119.39 22.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 117.534 -1.666 . . . . 0.0 108.324 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -169.2 147.74 3.83 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 130.212 3.405 . . . . 0.0 107.033 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -168.13 171.41 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 126.351 1.86 . . . . 0.0 107.979 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -126.68 127.74 70.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 42.7 t80 -141.08 147.24 38.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 4.9 t70 54.92 32.15 17.35 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.252 1.821 . . . . 0.0 109.691 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 m120 66.64 15.56 10.15 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 127.576 2.35 . . . . 0.0 113.357 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -123.66 154.77 38.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 124.395 1.078 . . . . 0.0 109.588 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.1 t -79.34 141.93 36.52 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -144.59 155.78 43.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.711 2.004 . . . . 0.0 111.493 -178.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -148.8 151.23 34.42 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 120.904 -1.122 . . . . 0.0 110.529 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 t -81.11 127.96 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 123.997 0.919 . . . . 0.0 110.626 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.3 p -98.14 164.4 12.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.803 1.241 . . . . 0.0 109.035 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.68 -12.37 61.3 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 126.506 1.922 . . . . 0.0 113.295 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.95 112.31 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.584 1.553 . . . . 0.0 109.208 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.402 ' C ' HD12 ' A' ' 33' ' ' ILE . 16.7 tt0 -96.83 146.92 24.46 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.719 0.808 . . . . 0.0 109.451 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.402 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.04 135.22 22.08 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.604 1.962 . . . . 0.0 109.139 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.3 151.58 29.88 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.452 2.768 . . . . 0.0 111.564 178.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -58.5 -22.6 55.59 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.528 0.731 . . . . 0.0 112.749 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -67.45 -25.84 66.1 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.937 -0.477 . . . . 0.0 110.517 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.63 -20.01 23.02 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 111.399 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.1 t -65.13 126.15 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -83.47 -61.3 1.88 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.733 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -163.87 168.95 18.86 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 126.159 1.783 . . . . 0.0 109.16 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.441 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 15.9 m -63.16 155.35 28.36 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.155 0.982 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -120.42 -54.73 2.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.737 -0.602 . . . . 0.0 110.592 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.2 t -146.99 146.81 18.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.58 125.38 53.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 104.047 -2.575 . . . . 0.0 104.047 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 158.43 44.06 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 126.274 1.83 . . . . 0.0 111.343 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.87 112.83 15.15 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.859 ' HE3' HD23 ' A' ' 49' ' ' LEU . 4.0 tmtm? -147.99 115.9 6.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.45 1.1 . . . . 0.0 109.113 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -131.78 134.77 46.2 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.112 1.365 . . . . 0.0 107.823 178.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.859 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -148.53 170.97 16.88 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.853 1.661 . . . . 0.0 108.425 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -129.28 129.6 67.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.5 t -120.93 134.03 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.67 1.188 . . . . 0.0 108.966 -178.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' A' ' 59' ' ' LEU . 3.9 t70 -80.68 126.03 30.77 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.03 -1.043 . . . . 0.0 109.574 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 76.5 mtp -68.23 -17.79 64.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.608 1.549 . . . . 0.0 113.808 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -65.0 -52.03 58.37 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.164 0.893 . . . . 0.0 111.094 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -122.19 6.25 9.71 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 60.66 24.79 14.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.484 1.514 . . . . 0.0 112.353 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.557 ' HE3' ' HA ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -93.27 151.15 19.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 120.931 -1.106 . . . . 0.0 109.157 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.485 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -70.8 146.21 49.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' A' ' 52' ' ' ASP . 50.6 mt -130.42 -179.59 5.35 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.328 2.251 . . . . 0.0 108.253 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.8 m -131.78 -5.06 3.62 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.693 1.197 . . . . 0.0 112.281 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -123.71 174.63 7.36 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.041 1.736 . . . . 0.0 106.963 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 t -109.28 110.44 21.63 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.262 87.5 m-20 -102.65 159.38 15.51 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.355 1.462 . . . . 0.0 107.747 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -70.52 -12.87 61.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.211 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -100.62 5.52 43.9 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.439 1.472 . . . . 0.0 110.55 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.7 t -113.78 173.75 6.27 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.012 1.725 . . . . 0.0 112.053 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.5 t -142.59 130.41 19.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 125.731 1.612 . . . . 0.0 107.784 178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -75.04 135.09 41.27 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -125.84 132.33 52.24 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 120.8 -1.187 . . . . 0.0 108.332 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -113.31 107.84 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.53 92.04 3.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.909 1.232 . . . . 0.0 110.981 -178.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -168.14 -164.34 0.53 Allowed 'General case' 0 CA--C 1.508 -0.672 0 O-C-N 121.199 -0.938 . . . . 0.0 111.736 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.94 66.79 0.87 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 123.882 0.739 . . . . 0.0 111.636 176.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 6.7 mt -79.61 138.61 19.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.3 m-85 -134.69 168.83 18.3 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.13 1.772 . . . . 0.0 107.768 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -110.9 157.9 19.34 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.486 1.514 . . . . 0.0 108.141 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.77 162.59 17.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 125.348 1.459 . . . . 0.0 109.457 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.1 t -56.42 -29.98 62.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.486 0.714 . . . . 0.0 111.098 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -85.08 12.29 8.04 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.82 -1.175 . . . . 0.0 112.517 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm 75.3 1.99 3.79 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.546 1.939 . . . . 0.0 110.462 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 m -74.72 167.69 21.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.439 1.096 . . . . 0.0 110.108 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.78 148.58 45.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.492 1.117 . . . . 0.0 110.204 -178.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.4 p -140.2 171.07 14.69 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.08 0.952 . . . . 0.0 109.414 178.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.5 ttm -131.36 134.65 46.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.357 1.863 . . . . 0.0 110.718 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.24 103.78 2.53 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 126.743 2.116 . . . . 0.0 110.573 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 65.7 mt -117.43 113.97 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.899 1.68 . . . . 0.0 108.074 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 33.5 m120 47.84 54.01 10.57 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 124.743 1.217 . . . . 0.0 112.585 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 75.21 -4.64 2.33 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.518 1.927 . . . . 0.0 115.473 178.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -115.85 147.48 40.99 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.378 1.445 . . . . 0.0 109.626 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -99.85 116.92 33.04 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -108.09 133.44 52.37 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.964 1.305 . . . . 0.0 111.176 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -67.87 151.09 47.72 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.19 -0.944 . . . . 0.0 110.059 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -118.58 133.66 64.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -119.59 156.75 53.25 Favored Pre-proline 0 N--CA 1.467 0.39 0 C-N-CA 125.238 1.415 . . . . 0.0 108.848 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.51 156.1 64.93 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.483 2.122 . . . . 0.0 109.888 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.36 65.18 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.577 -0.702 . . . . 0.0 109.68 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.0 t -70.88 -0.7 9.71 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.107 0.963 . . . . 0.0 110.516 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.97 -3.77 31.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.033 -1.667 . . . . 0.0 112.959 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -53.05 164.41 0.41 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.606 1.193 . . . . 0.0 112.701 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.62 -41.77 3.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 125.118 1.342 . . . . 0.0 111.823 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.75 -28.24 19.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.417 1.087 . . . . 0.0 110.573 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.9 p -134.02 162.9 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 127.38 2.272 . . . . 0.0 106.402 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -134.39 172.56 12.72 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.818 2.447 . . . . 0.0 106.875 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.68 168.71 14.3 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.23 172.51 6.85 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.711 -0.618 . . . . 0.0 112.46 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -118.22 138.88 52.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.341 1.056 . . . . 0.0 110.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.403 HD12 ' H ' ' A' ' 107' ' ' LEU . 1.6 mp -70.85 -13.13 61.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.162 0.585 . . . . 0.0 110.04 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -61.48 -10.13 7.11 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.243 2.217 . . . . 0.0 113.18 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -96.1 -4.65 42.45 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.726 0.81 . . . . 0.0 112.706 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 C--O 1.25 1.099 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.226 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 17.4 t80 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 117.643 -1.17 . . . . 0.0 113.064 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -106.55 33.95 3.64 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.682 1.583 . . . . 0.0 112.335 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.7 m -69.95 128.23 35.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.609 -1.307 . . . . 0.0 113.032 -178.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 t -161.48 160.46 29.24 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.521 1.529 . . . . 0.0 108.405 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -152.8 110.87 3.65 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.098 1.359 . . . . 0.0 109.065 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -137.91 160.45 39.29 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.268 1.427 . . . . 0.0 107.468 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -64.24 162.21 15.08 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.2 t -99.13 137.15 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -102.46 103.05 13.4 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 103.688 -2.708 . . . . 0.0 103.688 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -80.59 166.63 20.94 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.493 1.117 . . . . 0.0 110.697 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 2.2 p30 -59.24 -33.58 71.18 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.709 1.604 . . . . 0.0 113.798 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 51.19 91.96 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.101 2.56 . . . . 0.0 113.477 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 65.07 38.7 95.67 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 113.748 -1.569 . . . . 0.0 111.904 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 5.0 m -139.38 -179.89 6.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.349 2.259 . . . . 0.0 109.647 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.66 -170.07 0.8 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.617 1.567 . . . . 0.0 108.358 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 33.8 p -79.49 121.76 25.6 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 123.994 1.854 . . . . 0.0 110.438 -175.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -167.14 149.42 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 129.584 3.154 . . . . 0.0 107.234 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.47 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 38.8 p90 -164.27 167.27 20.11 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -131.53 112.83 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 O-C-N 120.452 -1.405 . . . . 0.0 108.278 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.416 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 86.9 t80 -117.55 137.07 52.83 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.067 0.947 . . . . 0.0 108.608 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.416 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 3.3 t70 55.25 34.22 22.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.175 1.79 . . . . 0.0 114.042 179.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 69.78 17.65 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.844 2.458 . . . . 0.0 111.933 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -119.08 138.24 53.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.963 1.705 . . . . 0.0 106.944 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.2 m -82.42 136.95 34.83 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -137.67 166.41 24.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.561 1.944 . . . . 0.0 112.125 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -148.99 163.66 36.86 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.495 0.718 . . . . 0.0 110.725 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 t -96.01 122.52 47.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 124.785 1.234 . . . . 0.0 108.466 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.78 172.82 7.01 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.517 1.127 . . . . 0.0 110.009 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -74.9 -14.98 60.71 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HE2' HG23 ' A' ' 102' ' ' VAL . 0.0 OUTLIER -69.51 110.95 5.03 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.065 0.946 . . . . 0.0 110.315 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.19 146.81 24.38 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.36 1.064 . . . . 0.0 108.524 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.6 mp -117.71 137.17 24.02 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 126.528 1.931 . . . . 0.0 105.946 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.6 153.05 49.02 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.447 2.098 . . . . 0.0 111.47 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.21 -30.19 64.36 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -65.9 -15.6 63.09 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.783 0.719 . . . . 0.0 112.686 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -97.9 -14.44 20.67 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.988 0.915 . . . . 0.0 111.14 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.405 HG21 ' CD2' ' A' ' 90' ' ' TYR . 69.9 t -78.23 135.35 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 C-N-CA 124.602 1.161 . . . . 0.0 108.001 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -91.66 -61.34 1.66 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.359 1.464 . . . . 0.0 111.038 -179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -156.23 158.71 38.01 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.7 t -70.45 131.43 44.04 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttp -101.12 -51.93 3.4 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 117.153 -1.403 . . . . 0.0 114.535 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.9 t -141.39 133.48 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 119.027 0.831 . . . . 0.0 110.191 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.21 117.2 33.43 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.335 1.054 . . . . 0.0 109.445 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -148.77 157.44 43.44 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.628 1.971 . . . . 0.0 110.128 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -123.3 120.71 33.88 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.963 -1.085 . . . . 0.0 108.398 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.4 tptm -147.51 124.02 11.05 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.725 1.21 . . . . 0.0 107.818 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 tt -134.19 143.96 48.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.623 1.969 . . . . 0.0 109.407 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -153.72 169.57 23.0 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 125.369 1.468 . . . . 0.0 107.838 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mt -130.33 133.82 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 125.192 1.397 . . . . 0.0 107.443 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.19 152.49 33.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 125.738 1.615 . . . . 0.0 108.129 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -88.89 124.83 34.58 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.347 1.859 . . . . 0.0 107.327 178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.9 mtp -68.35 -25.95 65.35 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 121.009 1.731 . . . . 0.0 109.863 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -53.56 54.09 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.362 1.065 . . . . 0.0 112.677 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -111.34 -6.14 14.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 65.0 20.2 12.05 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.819 1.19 . . . . 0.0 111.308 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -102.27 153.89 19.55 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.79 1.636 . . . . 0.0 108.637 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.77 154.59 39.51 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.335 0.516 . . . . 0.0 111.393 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.2 mt -135.56 160.28 38.98 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 125.791 1.636 . . . . 0.0 108.809 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -7.98 45.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.4 m -142.18 165.57 27.08 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.737 1.608 . . . . 0.0 110.071 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.4 p -92.39 117.01 29.48 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -132.23 163.06 29.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -47.38 -34.59 7.2 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -178.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -80.08 -7.1 58.71 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.829 -1.169 . . . . 0.0 112.634 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.8 t -120.55 164.28 16.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 127.346 2.258 . . . . 0.0 114.035 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -137.32 161.38 34.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 127.012 2.125 . . . . 0.0 106.353 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.1 t -110.87 144.84 39.29 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.016 1.327 . . . . 0.0 109.487 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.1 mt -131.19 144.72 51.56 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.0 t -122.94 101.73 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 101.658 -3.46 . . . . 0.0 101.658 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -87.87 96.07 10.34 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -178.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -169.01 -161.62 0.33 Allowed 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.59 66.93 1.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.639 1.576 . . . . 0.0 111.455 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 mt -79.36 137.1 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.166 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -134.99 168.86 18.34 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.967 1.707 . . . . 0.0 109.212 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -116.96 147.1 42.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.31 168.47 10.0 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 126.251 1.82 . . . . 0.0 110.637 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.9 t -60.31 -35.15 74.93 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -83.15 18.2 1.78 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.986 1.314 . . . . 0.0 112.178 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 65.26 12.5 8.09 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.256 1.422 . . . . 0.0 110.43 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.8 t -81.29 169.29 17.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.4 mt -123.55 154.99 38.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.413 0.685 . . . . 0.0 112.377 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.4 p -146.98 171.78 14.72 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.901 0.88 . . . . 0.0 110.035 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.2 ttm -133.58 135.98 44.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.368 1.867 . . . . 0.0 108.651 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.0 115.74 4.17 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 126.174 1.845 . . . . 0.0 112.865 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -132.76 122.84 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 55.7 36.92 28.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.39 1.876 . . . . 0.0 110.777 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 t0 70.02 13.82 7.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.14 2.176 . . . . 0.0 114.173 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -116.48 138.54 51.3 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.843 1.657 . . . . 0.0 107.823 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD2' HG21 ' A' ' 38' ' ' VAL . 18.6 m-85 -91.2 116.88 29.17 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.798 -0.564 . . . . 0.0 110.448 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -106.07 124.56 49.77 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.224 1.409 . . . . 0.0 107.597 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.401 ' HB2' HD13 ' A' ' 33' ' ' ILE . 11.1 ttpp -60.53 157.51 14.1 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.157 -0.964 . . . . 0.0 111.307 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.47 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -121.99 134.54 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.01 158.74 67.87 Favored Pre-proline 0 N--CA 1.469 0.484 0 C-N-CA 125.093 1.357 . . . . 0.0 107.877 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.08 153.69 67.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.161 1.907 . . . . 0.0 109.171 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 99' ' ' LYS . 17.2 pt-20 -65.53 -19.79 66.07 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 119.892 -0.723 . . . . 0.0 110.747 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -63.82 -19.46 65.04 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.266 1.426 . . . . 0.0 110.894 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -84.88 2.17 43.84 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 96' ' ' GLU . 36.3 mtmt -55.5 154.6 6.25 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.883 0.765 . . . . 0.0 110.033 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.76 -21.72 35.7 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.078 0.847 . . . . 0.0 111.83 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.15 -12.43 6.91 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 118.86 1.33 . . . . 0.0 111.182 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.416 HG23 ' HE2' ' A' ' 31' ' ' LYS . 3.8 p -141.35 155.86 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 C-N-CA 125.655 1.582 . . . . 0.0 107.286 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -130.06 164.73 23.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.999 1.72 . . . . 0.0 108.211 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 164.6 12.99 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.48 160.0 11.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.386 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -107.35 133.18 52.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 124.217 1.007 . . . . 0.0 111.275 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.47 -23.06 67.15 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.759 1.224 . . . . 0.0 110.041 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.11 -9.2 2.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.042 1.337 . . . . 0.0 113.664 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -84.43 -8.04 59.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.18 0.992 . . . . 0.0 111.053 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 C--O 1.245 0.86 0 C-N-CA 124.367 1.067 . . . . 0.0 111.17 -176.602 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.0 p90 . . . . . 0 N--CA 1.468 0.434 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -67.01 139.74 57.68 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.871 -1.899 . . . . 0.0 105.871 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 t -133.89 3.27 3.47 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -76.83 47.03 0.49 Allowed 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.665 1.121 . . . . 0.0 111.094 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -79.81 61.29 3.7 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.821 1.648 . . . . 0.0 107.291 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -106.69 167.32 9.95 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 125.8 1.64 . . . . 0.0 106.699 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.94 154.55 30.02 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.519 -0.738 . . . . 0.0 110.494 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.6 t -102.47 115.75 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 102.476 -3.157 . . . . 0.0 102.476 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -80.49 113.75 18.89 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.24 150.5 25.41 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -71.56 -34.05 69.63 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 119.636 -0.826 . . . . 0.0 111.358 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 66.51 137.44 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 128.174 2.59 . . . . 0.0 112.508 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.9 26.04 39.61 Favored Glycine 0 CA--C 1.533 1.172 0 O-C-N 121.294 -0.879 . . . . 0.0 113.202 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 m -140.26 177.68 7.82 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.519 1.928 . . . . 0.0 111.291 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.06 -168.33 0.61 Allowed 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.564 2.345 . . . . 0.0 107.025 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -79.85 121.87 25.95 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.781 -1.824 . . . . 0.0 110.113 -176.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -167.26 146.68 5.2 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 130.792 3.637 . . . . 0.0 105.646 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -168.79 167.4 11.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.259 1.424 . . . . 0.0 108.226 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.5 mt -130.92 113.22 23.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 O-C-N 121.595 -0.691 . . . . 0.0 109.251 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -120.01 139.98 51.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 53.27 33.2 14.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 123.029 1.395 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 56.84 30.14 17.32 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.034 2.534 . . . . 0.0 111.632 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.9 mtpp -123.16 132.37 54.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.682 1.993 . . . . 0.0 105.634 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.5 p -71.45 139.67 49.73 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -145.66 163.08 35.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.156 1.782 . . . . 0.0 109.385 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 p90 -149.14 162.02 40.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -95.75 127.04 48.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.407 HG21 HD23 ' A' ' 94' ' ' LEU . 26.3 p -96.57 171.86 8.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.693 1.597 . . . . 0.0 110.574 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.42 -10.25 59.35 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.542 1.937 . . . . 0.0 112.41 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.09 103.55 1.56 Allowed 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 126.081 1.752 . . . . 0.0 110.173 -179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.418 ' C ' HD12 ' A' ' 33' ' ' ILE . 31.3 tt0 -94.29 142.25 27.63 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.418 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.9 mp -116.21 142.63 29.62 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 124.331 1.052 . . . . 0.0 109.389 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 33' ' ' ILE . 96.0 Cg_endo -77.9 150.62 27.05 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.649 2.899 . . . . 0.0 110.408 178.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -54.37 -29.99 50.39 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -63.36 -19.96 65.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.264 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -97.69 -14.05 21.12 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.417 0.553 . . . . 0.0 111.749 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.62 119.84 25.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -77.24 -61.49 1.97 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.394 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.56 173.74 15.06 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.074 0.95 . . . . 0.0 110.809 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.496 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -63.21 163.47 10.24 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.7 1.2 . . . . 0.0 111.452 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -134.1 -53.19 0.85 Allowed 'General case' 0 CA--C 1.518 -0.261 0 O-C-N 121.075 -1.016 . . . . 0.0 109.241 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -144.68 132.33 16.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -108.46 92.65 4.14 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.541 1.162 . . . . 0.0 109.569 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -132.09 156.49 46.23 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 128.345 2.658 . . . . 0.0 105.738 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -134.94 118.3 16.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.494 1.918 . . . . 0.0 108.281 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.607 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -146.71 137.62 24.04 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -134.63 145.58 48.74 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.641 1.977 . . . . 0.0 107.839 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -151.54 170.29 20.01 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 107.302 179.325 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.443 ' O ' HD13 ' A' ' 58' ' ' LEU . 39.5 mt -127.5 128.79 70.17 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.154 0 C-N-CA 123.316 0.646 . . . . 0.0 109.329 -177.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.78 137.09 51.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 125.464 1.506 . . . . 0.0 110.554 -178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.88 117.04 23.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 129.284 3.034 . . . . 0.0 111.784 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 70.3 mtp -68.2 -14.49 63.02 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.683 -1.261 . . . . 0.0 112.247 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -69.74 -53.32 18.96 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.827 -1.17 . . . . 0.0 111.53 178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.8 m -122.79 10.53 9.6 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 58.95 21.08 8.82 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.178 1.391 . . . . 0.0 112.873 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 mtmm -96.81 161.73 13.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 123.742 0.817 . . . . 0.0 110.59 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.5 mm? -82.95 153.61 24.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.1 mt -135.18 160.93 36.8 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.696 1.198 . . . . 0.0 110.437 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -78.84 -25.8 44.11 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.04 0.536 . . . . 0.0 110.4 177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.27 158.66 43.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.505 1.122 . . . . 0.0 108.906 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.09 116.5 27.41 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.78 173.84 9.18 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -63.23 -18.59 63.7 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.137 -0.977 . . . . 0.0 112.238 177.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -103.6 18.18 22.45 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.458 1.503 . . . . 0.0 109.758 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.34 158.57 33.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.246 1.818 . . . . 0.0 108.609 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.0 t -133.31 145.58 33.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 125.068 1.347 . . . . 0.0 107.572 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -93.7 137.23 33.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.66 136.25 49.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 t -107.58 103.35 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 102.998 -2.964 . . . . 0.0 102.998 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.402 ' CD2' HD11 ' A' ' 49' ' ' LEU . 2.8 mm? -95.9 92.19 6.39 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 -166.06 0.89 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 51.67 67.49 0.95 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 122.557 1.17 . . . . 0.0 112.314 176.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.83 134.35 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.984 -1.073 . . . . 0.0 109.957 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 40.9 m-85 -135.16 169.86 16.8 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.735 2.014 . . . . 0.0 110.452 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -112.93 159.79 18.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.144 2.178 . . . . 0.0 109.866 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.76 169.56 9.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.218 1.407 . . . . 0.0 110.593 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -25.36 63.49 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.44 0.696 . . . . 0.0 112.011 179.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -98.8 15.15 26.32 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.09 -1.006 . . . . 0.0 112.338 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp 71.69 2.32 4.24 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.969 1.708 . . . . 0.0 112.617 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.7 m -70.28 159.36 34.2 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -114.04 156.66 23.71 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.26 -0.9 . . . . 0.0 111.046 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -143.77 170.96 14.89 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.158 0.983 . . . . 0.0 110.088 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.5 ttm -134.59 137.37 43.68 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 126.618 1.967 . . . . 0.0 108.982 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.86 124.11 6.38 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 126.194 1.854 . . . . 0.0 109.98 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.5 mt -144.18 120.87 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 53.1 45.5 28.58 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.545 0.738 . . . . 0.0 110.843 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.6 t0 60.33 17.65 7.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.52 1.928 . . . . 0.0 113.995 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.1 137.48 54.91 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 126.27 1.828 . . . . 0.0 108.269 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.58 116.99 29.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 122.488 0.315 . . . . 0.0 110.773 -178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -106.19 125.78 51.42 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.288 1.435 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -62.66 145.35 54.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.713 0.805 . . . . 0.0 110.75 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.76 133.01 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 106.079 -1.823 . . . . 0.0 106.079 179.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.407 HD23 HG21 ' A' ' 29' ' ' THR . 4.4 mm? -124.99 156.57 69.03 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.557 1.143 . . . . 0.0 109.777 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.08 141.64 33.09 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 N-CA-C 107.301 -1.846 . . . . 0.0 107.301 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -58.96 -13.75 7.31 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.7 t -68.8 -16.35 63.77 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.65 -6.2 54.87 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 119.638 1.108 . . . . 0.0 113.473 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -56.03 157.69 4.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.886 0.851 . . . . 0.0 109.719 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.93 -23.5 35.75 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 108.353 -1.899 . . . . 0.0 108.353 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.95 -7.35 13.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.004 2.121 . . . . 0.0 109.393 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 p -156.98 158.01 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 129.083 2.953 . . . . 0.0 105.242 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -135.6 170.66 15.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.979 1.712 . . . . 0.0 106.732 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.1 162.74 11.14 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.541 0.686 . . . . 0.0 110.979 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.643 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.17 163.2 3.87 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.498 -179.223 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.643 ' N ' HD12 ' A' ' 105' ' ' LEU . 40.9 mtm180 -116.48 139.14 50.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 124.289 1.036 . . . . 0.0 111.684 -177.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.51 -19.62 62.17 Favored 'General case' 0 C--O 1.22 -0.464 0 O-C-N 123.963 0.789 . . . . 0.0 110.797 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.2 -2.88 2.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.417 1.887 . . . . 0.0 113.158 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -93.71 0.57 56.47 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.039 -1.038 . . . . 0.0 110.003 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 125.049 1.339 . . . . 0.0 110.906 -178.046 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 42.7 p90 . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 118.038 -0.982 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.84 141.19 57.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.859 1.663 . . . . 0.0 108.146 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.2 p -141.87 108.79 5.43 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 118.624 0.647 . . . . 0.0 110.678 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 t -164.35 164.35 22.23 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -52.97 -38.25 61.96 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.248 1.019 . . . . 0.0 111.989 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt 44.29 54.89 5.9 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.782 1.633 . . . . 0.0 110.308 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -46.21 118.73 2.02 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.356 1.062 . . . . 0.0 109.221 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -81.23 138.17 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 124.523 1.129 . . . . 0.0 108.213 -178.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -106.6 133.32 51.46 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -102.55 161.12 13.97 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -66.31 -32.89 74.56 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 64.93 137.85 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 128.627 2.771 . . . . 0.0 112.851 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.34 28.83 44.64 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 t -139.97 178.35 7.32 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.106 2.162 . . . . 0.0 110.923 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.59 -169.49 0.7 Allowed 'General case' 0 C--O 1.246 0.89 1 C-N-CA 132.02 4.128 . . . . 0.0 107.867 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.9 p -80.61 118.84 22.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 116.956 -1.897 . . . . 0.0 108.682 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -169.13 144.95 3.31 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 130.677 3.591 . . . . 0.0 105.676 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.4 p90 -165.49 177.86 7.15 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.555 1.142 . . . . 0.0 108.926 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.9 mt -133.86 125.76 49.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -139.06 140.74 38.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.371 1.468 . . . . 0.0 108.564 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t0 48.52 40.88 16.11 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.243 2.217 . . . . 0.0 113.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.9 m120 67.77 22.96 8.7 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 127.797 2.439 . . . . 0.0 114.042 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 mtpp -130.55 152.8 49.53 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.166 0.986 . . . . 0.0 109.185 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.2 t -79.19 143.39 35.44 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.3 m-85 -147.19 161.08 41.64 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 122.727 0.411 . . . . 0.0 111.248 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.462 ' CE2' HG22 ' A' ' 29' ' ' THR . 47.0 p90 -148.7 159.6 43.96 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.583 0.753 . . . . 0.0 109.453 178.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.0 t -92.49 127.79 44.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.462 HG22 ' CE2' ' A' ' 27' ' ' PHE . 1.1 p -99.47 171.98 7.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.004 0.906 . . . . 0.0 110.91 -178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -76.36 -5.69 48.29 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 127.11 2.164 . . . . 0.0 113.1 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -81.46 104.14 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 124.327 1.051 . . . . 0.0 109.614 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -92.03 140.85 29.24 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -117.13 135.47 23.1 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.83 152.6 68.97 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.097 2.531 . . . . 0.0 111.205 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.37 -26.08 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 122.008 -0.432 . . . . 0.0 110.992 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -66.58 -19.5 65.79 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.59 -0.694 . . . . 0.0 112.044 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -96.55 -14.77 22.02 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.066 1.746 . . . . 0.0 111.028 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.3 t -67.5 139.11 21.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -88.06 -54.18 4.35 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.151 1.38 . . . . 0.0 110.807 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.6 p-10 -171.06 169.33 6.61 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.314 1.446 . . . . 0.0 110.892 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.6 p -65.55 161.09 20.96 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.274 1.83 . . . . 0.0 109.466 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -130.62 -56.05 1.07 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.573 -1.203 . . . . 0.0 112.306 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.9 t -148.79 143.73 18.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 119.194 0.906 . . . . 0.0 111.444 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -121.96 109.28 14.41 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.967 1.307 . . . . 0.0 109.82 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -136.81 156.69 48.17 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 130.853 3.661 . . . . 0.0 105.723 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -117.7 114.94 24.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.576 1.08 . . . . 0.0 109.941 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.576 ' HE3' HD23 ' A' ' 49' ' ' LEU . 9.3 tptm -147.02 122.58 10.44 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.073 0.949 . . . . 0.0 109.556 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.416 HD12 HG22 ' A' ' 70' ' ' VAL . 9.7 tt -135.76 141.34 44.81 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.943 2.097 . . . . 0.0 107.578 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.61 HD22 HD11 ' A' ' 58' ' ' LEU . 0.8 OUTLIER -151.61 171.31 17.82 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.682 1.193 . . . . 0.0 109.725 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.2 mt -123.98 130.52 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.7 t -125.88 151.92 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.511 1.525 . . . . 0.0 107.238 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -101.52 126.58 48.35 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.2 1.364 . . . . 0.0 108.321 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.8 mtp -64.91 -21.19 66.77 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.793 1.633 . . . . 0.0 112.323 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -54.56 38.96 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 119.052 0.842 . . . . 0.0 112.795 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.2 m -112.62 -2.51 14.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.755 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 59.5 34.61 22.57 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.468 1.907 . . . . 0.0 111.162 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -111.82 156.75 21.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.494 0.717 . . . . 0.0 110.464 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.61 HD11 HD22 ' A' ' 49' ' ' LEU . 3.6 mm? -67.53 142.45 56.54 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.087 . . . . 0.0 110.12 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.3 mt -120.7 175.72 5.88 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.142 1.777 . . . . 0.0 110.787 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.2 m -116.2 3.67 13.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.586 2.355 . . . . 0.0 111.019 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.1 t -160.16 160.79 33.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 p -97.68 121.18 39.28 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.346 1.459 . . . . 0.0 107.679 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.65 168.29 15.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.382 1.073 . . . . 0.0 110.607 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -50.74 -41.84 56.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -77.74 -1.68 32.47 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.769 0.713 . . . . 0.0 111.535 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.6 t -112.77 163.5 14.51 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.804 1.642 . . . . 0.0 110.831 -178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.32 134.26 17.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 129.315 3.046 . . . . 0.0 104.935 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.49 144.23 28.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -127.24 145.44 50.78 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.416 HG22 HD12 ' A' ' 48' ' ' LEU . 7.7 t -120.43 104.14 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 103.141 -2.911 . . . . 0.0 103.141 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -98.23 93.76 6.41 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -169.17 -167.48 0.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 t30 49.89 67.98 0.82 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.836 1.654 . . . . 0.0 113.123 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.6 mt -71.47 144.42 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.353 1.461 . . . . 0.0 111.952 -178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -137.36 169.46 17.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.373 2.669 . . . . 0.0 110.102 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -121.48 154.65 36.32 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 126.414 1.886 . . . . 0.0 108.136 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.88 166.97 10.51 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 125.753 1.621 . . . . 0.0 109.978 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m -62.17 -27.56 69.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.415 0.286 . . . . 0.0 111.054 178.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -84.35 15.42 3.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.834 1.254 . . . . 0.0 110.471 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.9 mmmm 66.57 4.44 3.34 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.9 1.68 . . . . 0.0 111.056 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.01 164.65 26.38 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 178.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.0 mt -116.66 155.22 29.19 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 109.145 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.3 p -147.81 166.75 26.63 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.89 0.476 . . . . 0.0 110.039 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 50.5 ttm -130.86 141.95 50.35 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 126.077 1.751 . . . . 0.0 110.249 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.27 121.82 5.66 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 125.49 1.519 . . . . 0.0 110.483 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.2 mt -140.77 116.72 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 104.451 -2.426 . . . . 0.0 104.451 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 53.44 51.13 15.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.81 0.844 . . . . 0.0 110.628 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 62.4 -2.89 0.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.389 2.676 . . . . 0.0 115.769 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -101.98 138.35 39.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.368 1.867 . . . . 0.0 108.581 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -96.21 116.48 29.07 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -105.8 127.86 53.36 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.873 1.669 . . . . 0.0 109.33 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.415 ' HB2' HD13 ' A' ' 33' ' ' ILE . 23.3 ttpt -63.41 150.73 42.89 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.994 0.918 . . . . 0.0 110.152 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -119.3 133.68 65.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 179.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -126.07 161.24 52.82 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.388 1.075 . . . . 0.0 110.03 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.45 153.83 65.46 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.864 2.376 . . . . 0.0 109.611 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.2 pm0 -56.56 -22.83 36.1 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.491 0.716 . . . . 0.0 110.819 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.6 m -57.17 -22.65 41.93 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.903 1.681 . . . . 0.0 111.19 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -76.31 1.1 17.09 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.731 1.212 . . . . 0.0 113.2 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.75 143.21 37.54 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 120.968 -1.083 . . . . 0.0 110.61 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.82 -42.44 1.9 Allowed Glycine 0 CA--C 1.522 0.508 0 C-N-CA 125.806 1.669 . . . . 0.0 110.737 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.65 -16.1 13.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.587 1.193 . . . . 0.0 111.771 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.51 143.47 41.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -135.15 169.61 17.18 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.465 1.106 . . . . 0.0 108.929 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.9 158.37 30.83 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.509 0.671 . . . . 0.0 109.602 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.19 164.12 13.83 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.489 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -113.24 135.78 53.45 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.362 1.065 . . . . 0.0 110.032 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.539 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.7 OUTLIER -65.43 -10.64 35.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.971 1.709 . . . . 0.0 111.386 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -60.29 -25.36 65.68 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.696 1.599 . . . . 0.0 111.47 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -72.79 -0.23 12.77 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.397 -177.914 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.2 t80 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -141.0 -76.84 0.3 Allowed 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.429 ' HB ' ' HE3' ' A' ' 7' ' ' LYS . 20.4 p -73.19 123.04 22.87 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 120.085 1.311 . . . . 0.0 110.8 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 m -125.81 -19.47 4.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.585 1.554 . . . . 0.0 112.674 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -129.37 100.71 5.68 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.931 1.293 . . . . 0.0 108.919 -179.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.429 ' HE3' ' HB ' ' A' ' 4' ' ' THR . 10.3 mtmp? -134.81 166.23 23.46 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.308 0.643 . . . . 0.0 111.536 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -59.61 155.35 15.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.293 1.437 . . . . 0.0 109.97 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.61 153.49 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -120.69 122.02 39.54 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 102.865 -3.013 . . . . 0.0 102.865 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -105.71 -178.03 3.53 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 120.822 1.646 . . . . 0.0 112.633 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -56.95 -33.95 67.53 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 129.153 2.981 . . . . 0.0 115.15 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 38.34 70.71 0.19 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 127.911 2.484 . . . . 0.0 114.28 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.0 7.97 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 113.6 -1.636 . . . . 0.0 111.981 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 179.26 6.57 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.021 0.928 . . . . 0.0 110.533 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.1 -169.62 0.64 Allowed 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.9 p -78.29 122.07 25.25 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 119.467 -2.021 . . . . 0.0 110.559 -174.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -166.27 147.03 6.4 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 130.479 3.512 . . . . 0.0 105.938 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 36.5 p90 -167.0 172.76 9.88 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 125.439 1.495 . . . . 0.0 107.917 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.2 mt -134.95 121.94 35.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 O-C-N 120.537 -1.352 . . . . 0.0 108.669 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -132.62 137.36 46.99 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.136 1.374 . . . . 0.0 107.83 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.45 34.13 17.55 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.149 1.38 . . . . 0.0 112.915 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 71.52 9.79 6.44 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.131 2.572 . . . . 0.0 113.277 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -111.04 139.17 46.63 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 134.04 38.71 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.5 m-85 -137.28 166.63 23.33 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 125.037 1.335 . . . . 0.0 110.354 -178.355 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -149.21 170.47 18.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.3 t -105.04 123.42 59.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 p -92.81 169.51 10.41 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.91 1.684 . . . . 0.0 110.503 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -79.2 -10.16 59.75 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.258 1.423 . . . . 0.0 111.978 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.74 100.15 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.826 0.851 . . . . 0.0 109.039 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -86.49 147.21 26.08 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.76 137.43 24.31 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.99 1.316 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.83 147.47 75.04 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.729 2.286 . . . . 0.0 109.326 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -55.78 -32.96 63.93 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.387 0.675 . . . . 0.0 112.728 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -64.9 -21.88 66.89 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.954 0.901 . . . . 0.0 112.075 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -90.98 -19.76 22.87 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.489 -0.757 . . . . 0.0 110.432 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.9 t -70.3 129.55 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -83.12 -61.58 1.82 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.74 0.816 . . . . 0.0 110.529 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -161.12 169.67 21.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.483 0.583 . . . . 0.0 110.763 -178.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.7 p -64.77 153.03 41.11 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.026 0.93 . . . . 0.0 109.327 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.589 ' HE3' HD12 ' A' ' 82' ' ' LEU . 8.6 ttmm -124.66 -50.36 1.74 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.2 t -149.71 140.69 16.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -106.84 121.08 43.68 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.802 1.241 . . . . 0.0 108.073 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -150.3 159.03 44.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.423 3.489 . . . . 0.0 105.85 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.45 107.39 5.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -138.36 129.8 27.6 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.5 tt -137.84 138.41 39.1 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.17 169.3 18.14 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 125.284 1.433 . . . . 0.0 107.343 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 65.7 mt -124.43 131.21 73.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.3 t -122.25 127.62 75.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 124.865 1.266 . . . . 0.0 110.837 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HB2' HD21 ' A' ' 59' ' ' LEU . 38.2 t70 -74.63 100.16 3.86 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 126.794 2.038 . . . . 0.0 107.482 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 73.1 mtp -55.22 -29.14 57.38 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.488 0.585 . . . . 0.0 112.157 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.64 84.67 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 125.03 1.332 . . . . 0.0 113.556 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -121.85 -4.63 9.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.955 1.252 . . . . 0.0 112.216 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 63.26 34.57 13.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.769 2.028 . . . . 0.0 110.291 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -119.83 157.14 29.28 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.095 0.958 . . . . 0.0 110.937 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.44 151.41 44.02 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.022 0.529 . . . . 0.0 111.648 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 52' ' ' ASP . 46.4 mt -134.84 174.49 10.53 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.726 2.01 . . . . 0.0 109.07 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 21.0 p -117.16 -5.31 11.37 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.707 1.603 . . . . 0.0 112.705 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 m -144.88 129.97 18.5 Favored 'General case' 0 CA--C 1.521 -0.166 0 O-C-N 120.001 -1.687 . . . . 0.0 107.7 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.59 122.48 23.99 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -127.77 170.7 12.46 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.937 2.095 . . . . 0.0 108.349 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -58.63 -13.13 5.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 -177.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -104.9 8.64 34.71 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.827 1.194 . . . . 0.0 109.325 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.21 162.03 27.12 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.441 1.097 . . . . 0.0 112.793 -177.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -132.31 160.04 42.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 126.363 1.865 . . . . 0.0 108.251 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 t -105.72 142.7 34.99 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -134.24 120.46 20.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.49 103.22 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -91.85 93.01 8.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -162.05 -169.22 2.12 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 t30 48.12 67.4 0.84 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.848 2.059 . . . . 0.0 113.183 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.8 mt -73.59 146.81 9.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 O-C-N 121.057 -1.027 . . . . 0.0 111.064 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -142.75 169.47 17.51 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 126.674 1.989 . . . . 0.0 111.191 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -114.53 158.11 22.09 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 127.307 2.243 . . . . 0.0 106.103 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.58 167.41 14.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.597 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.5 t -62.99 -23.5 67.47 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 122.979 0.512 . . . . 0.0 111.481 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -86.7 6.63 30.33 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 120.805 -1.185 . . . . 0.0 109.47 179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm 68.89 1.18 3.02 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.976 2.51 . . . . 0.0 111.056 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.5 m -73.81 154.97 39.3 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.589 HD12 ' HE3' ' A' ' 42' ' ' LYS . 1.2 mm? -108.71 152.88 24.23 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.161 0.984 . . . . 0.0 110.341 -178.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.6 p -141.2 177.38 8.12 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.088 0.47 . . . . 0.0 111.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.9 ttm -136.69 138.23 40.83 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 126.234 1.814 . . . . 0.0 109.398 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.65 118.44 4.67 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 107.522 -2.231 . . . . 0.0 107.522 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -135.03 123.35 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.6 m120 49.95 45.13 25.38 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 123.789 0.681 . . . . 0.0 109.878 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 63.15 18.99 11.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.528 1.931 . . . . 0.0 114.836 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -124.46 144.78 49.89 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.173 0.989 . . . . 0.0 109.844 178.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -94.15 115.99 28.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.735 0.698 . . . . 0.0 112.047 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.81 124.07 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.205 1.402 . . . . 0.0 109.764 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -62.28 147.94 46.49 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.54 1.136 . . . . 0.0 111.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -115.95 134.33 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 123.887 0.875 . . . . 0.0 109.238 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -127.6 158.46 69.91 Favored Pre-proline 0 C--O 1.235 0.313 0 C-N-CA 124.671 1.189 . . . . 0.0 109.983 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -75.39 154.3 40.6 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.718 2.279 . . . . 0.0 110.811 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.94 -6.48 12.62 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.957 -0.465 . . . . 0.0 111.811 178.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.3 p -72.86 -14.55 61.52 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.488 -1.382 . . . . 0.0 110.451 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.21 -4.92 58.02 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 142.51 34.08 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.01 0.924 . . . . 0.0 111.208 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.53 -15.24 19.99 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 126.107 1.813 . . . . 0.0 111.079 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.43 -12.68 0.8 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.473 1.509 . . . . 0.0 111.95 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.1 150.24 31.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -141.57 162.74 34.74 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.103 1.361 . . . . 0.0 108.368 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.31 167.02 1.47 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.572 0.701 . . . . 0.0 112.884 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.16 161.25 13.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.693 0.759 . . . . 0.0 112.559 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.0 mmm-85 -109.24 117.26 33.65 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -6.02 16.77 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.369 0.418 . . . . 0.0 111.795 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -59.52 -23.49 62.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 110.491 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -69.14 -12.09 61.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.728 0.811 . . . . 0.0 112.554 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.943 1.697 . . . . 0.0 107.746 -178.526 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 11.8 t80 . . . . . 0 N--CA 1.464 0.227 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -53.66 154.19 3.89 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.092 0.957 . . . . 0.0 111.107 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.5 m -138.46 98.54 3.61 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 m -132.42 147.97 52.39 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.442 1.497 . . . . 0.0 109.655 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.413 ' O ' ' HE3' ' A' ' 7' ' ' LYS . 19.5 p80 -161.75 143.62 11.41 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.748 0.819 . . . . 0.0 110.23 179.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 6' ' ' HIS . 3.9 mmpt? -144.27 173.05 12.1 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 127.283 2.233 . . . . 0.0 107.599 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.48 154.46 20.7 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.148 0.885 . . . . 0.0 110.376 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.2 t -95.06 133.17 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 125.627 1.571 . . . . 0.0 107.997 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -95.52 122.16 37.97 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -89.38 161.56 16.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -68.98 -33.78 74.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.827 1.651 . . . . 0.0 111.602 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 46.68 99.18 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 127.291 2.236 . . . . 0.0 114.802 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.74 20.75 53.12 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.039 -1.437 . . . . 0.0 112.395 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.91 179.53 6.12 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.75 1.62 . . . . 0.0 111.661 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -169.94 0.98 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.056 2.142 . . . . 0.0 107.361 177.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.0 p -80.63 120.4 24.52 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 124.586 2.136 . . . . 0.0 111.681 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -168.58 153.54 6.24 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 130.941 3.696 . . . . 0.0 106.108 177.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -168.52 173.79 7.26 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.0 mt -132.92 120.19 40.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -130.58 138.13 50.0 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t0 55.57 35.22 24.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.601 1.56 . . . . 0.0 112.071 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 65.1 15.65 10.12 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 127.345 2.258 . . . . 0.0 112.842 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -118.66 142.1 47.98 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.9 m -75.63 142.83 42.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -139.8 162.57 34.82 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.076 1.751 . . . . 0.0 109.585 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -148.86 166.81 27.42 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.675 1.19 . . . . 0.0 109.129 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.1 t -97.33 128.64 48.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 C-N-CA 123.04 0.536 . . . . 0.0 109.599 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 HD23 ' A' ' 94' ' ' LEU . 27.0 p -97.0 170.25 9.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.129 0.972 . . . . 0.0 111.112 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -77.82 -14.43 59.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.962 1.305 . . . . 0.0 111.982 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -69.01 101.21 1.35 Allowed 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 125.264 1.426 . . . . 0.0 110.614 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.404 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.0 tt0 -90.14 141.6 28.53 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.421 HG23 ' HD2' ' A' ' 34' ' ' PRO . 1.7 mp -118.14 143.98 33.95 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.482 1.113 . . . . 0.0 108.389 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 33' ' ' ILE . 74.5 Cg_endo -71.78 154.93 58.9 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.304 3.336 . . . . 0.0 113.383 -178.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -58.22 -33.34 69.21 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.124 0.97 . . . . 0.0 111.9 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -62.52 -23.16 66.8 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.748 0.819 . . . . 0.0 111.539 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.49 -22.84 21.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.184 0.594 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.98 119.3 6.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -77.5 -59.96 2.56 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.082 0.953 . . . . 0.0 110.223 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.37 20.11 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.511 0.725 . . . . 0.0 110.533 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.406 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -65.38 165.33 12.04 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.031 0.92 . . . . 0.0 108.724 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.89 -53.37 1.42 Allowed 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 120.785 -1.197 . . . . 0.0 108.631 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 t -140.86 145.4 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm -124.81 92.95 3.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.665 1.186 . . . . 0.0 108.566 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -137.32 155.31 49.59 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 128.962 2.905 . . . . 0.0 106.851 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -120.96 130.49 53.86 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.856 0.862 . . . . 0.0 111.844 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -148.81 126.85 11.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.403 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.4 tt -131.25 145.06 51.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.179 2.592 . . . . 0.0 110.256 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.467 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -152.3 171.04 18.6 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.588 1.955 . . . . 0.0 109.506 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.4 mt -128.34 127.77 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.187 1.395 . . . . 0.0 108.096 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 t -122.68 148.8 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.43 1.492 . . . . 0.0 109.131 -179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' A' ' 59' ' ' LEU . 4.8 t0 -92.83 125.98 37.7 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.185 1.394 . . . . 0.0 107.468 178.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 75.6 mtp -67.87 -26.23 65.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.869 1.213 . . . . 0.0 110.605 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -63.04 -41.55 99.52 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.4 m -121.99 -1.61 9.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.588 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 60.98 27.28 17.17 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.953 1.301 . . . . 0.0 109.835 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 9.3 mmpt? -103.45 154.03 19.88 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.391 1.076 . . . . 0.0 110.84 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.403 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -69.65 155.11 41.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 52' ' ' ASP . 89.6 mt -131.32 175.12 9.4 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.164 1.386 . . . . 0.0 109.726 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -113.94 -4.81 13.21 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.315 1.446 . . . . 0.0 110.68 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.6 p -152.41 154.06 34.82 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 120.393 1.452 . . . . 0.0 108.98 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -84.59 124.44 31.44 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -129.07 165.58 20.94 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.662 1.585 . . . . 0.0 108.392 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -56.08 -43.72 78.29 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.429 -0.794 . . . . 0.0 112.359 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -74.61 5.74 4.53 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.6 t -113.58 166.25 11.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.324 1.45 . . . . 0.0 111.034 -179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.8 t -143.48 123.8 9.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 126.704 2.002 . . . . 0.0 106.358 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.8 t -80.51 144.32 32.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.39 147.26 52.55 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.78 103.5 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -99.05 91.76 5.17 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -166.97 0.96 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -176.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 55.79 67.09 1.06 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.676 0.391 . . . . 0.0 111.716 176.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mt -77.36 138.16 20.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.569 0.747 . . . . 0.0 110.632 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.406 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.7 m-85 -137.45 169.65 17.42 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 127.175 2.19 . . . . 0.0 109.808 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -118.17 156.76 28.17 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.125 1.77 . . . . 0.0 108.283 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.01 171.05 7.77 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 126.031 1.732 . . . . 0.0 112.375 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.2 p -57.07 -37.0 71.22 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 127.309 2.244 . . . . 0.0 112.176 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -87.72 16.13 6.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.532 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 69.38 -1.34 2.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 126.821 2.049 . . . . 0.0 111.134 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.67 164.89 20.55 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.86 0.755 . . . . 0.0 109.614 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.09 144.9 41.84 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.829 1.252 . . . . 0.0 109.415 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.37 168.25 20.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.869 0.868 . . . . 0.0 109.52 178.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 38.4 ttm -134.07 143.24 47.91 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.948 1.699 . . . . 0.0 109.749 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.85 124.43 6.85 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 125.217 1.389 . . . . 0.0 110.43 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 57.0 mt -143.13 120.92 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 53.8 44.81 29.03 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.293 1.044 . . . . 0.0 109.607 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.13 14.6 3.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.706 2.802 . . . . 0.0 114.327 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -116.86 147.48 42.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.722 1.609 . . . . 0.0 107.198 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -98.9 116.52 31.33 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.931 0.892 . . . . 0.0 112.527 -177.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -108.49 128.26 54.65 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.683 1.593 . . . . 0.0 109.781 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.697 ' HE2' HD21 ' A' ' 94' ' ' LEU . 7.3 ttpt -65.75 151.0 47.6 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.413 -0.804 . . . . 0.0 110.164 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.56 134.29 63.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.697 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.3 mm? -122.32 157.91 57.29 Favored Pre-proline 0 C--O 1.233 0.237 0 C-N-CA 124.023 0.929 . . . . 0.0 110.119 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.59 155.71 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.377 2.052 . . . . 0.0 110.346 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.64 -9.2 25.08 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.375 -0.828 . . . . 0.0 110.557 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 m -70.82 -8.1 50.1 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.279 2.232 . . . . 0.0 110.72 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . 0.257 0.0 OUTLIER -114.49 3.15 14.83 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -51.28 161.09 0.47 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.866 1.266 . . . . 0.0 111.784 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.33 -42.54 3.11 Favored Glycine 0 CA--C 1.522 0.519 0 O-C-N 120.926 -1.109 . . . . 0.0 111.351 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.96 53.18 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.124 1.462 . . . . 0.0 108.983 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.5 147.94 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 C-N-CA 126.443 1.897 . . . . 0.0 108.622 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -114.15 167.44 10.68 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.027 1.331 . . . . 0.0 108.508 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.88 166.08 20.24 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.851 0.834 . . . . 0.0 109.317 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -61.41 157.95 15.71 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.351 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.473 ' N ' HD12 ' A' ' 105' ' ' LEU . 41.0 ptt180 -110.45 139.46 45.65 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.005 0.922 . . . . 0.0 113.27 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.2 -28.15 69.18 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.976 1.71 . . . . 0.0 110.105 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -53.22 -30.31 37.23 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.006 1.722 . . . . 0.0 113.792 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -70.08 -11.29 60.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.432 0.693 . . . . 0.0 109.661 -177.22 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 8.2 t80 . . . . . 0 N--CA 1.468 0.469 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -139.44 131.63 28.16 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.764 -1.21 . . . . 0.0 109.356 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.3 m -158.18 148.31 20.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 106.943 -1.502 . . . . 0.0 106.943 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 t -73.99 -175.76 2.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 1.0 . . . . 0.0 109.5 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -67.09 156.64 35.61 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.057 -1.027 . . . . 0.0 109.462 178.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -138.31 -177.37 4.81 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.563 1.945 . . . . 0.0 109.362 -178.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.74 111.37 15.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.088 1.355 . . . . 0.0 109.735 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.7 t -71.19 145.49 12.52 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 CA-C-N 119.193 0.906 . . . . 0.0 109.224 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 -103.14 97.35 7.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.5 145.0 41.72 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.24 -25.44 63.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.701 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 66.78 142.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.671 2.389 . . . . 0.0 112.901 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.99 28.03 15.89 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.249 0.928 . . . . 0.0 112.928 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -137.28 177.89 7.51 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 125.305 1.442 . . . . 0.0 110.931 -178.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -74.79 -168.9 0.79 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 127.173 2.189 . . . . 0.0 107.701 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.251 7.7 p -79.61 120.21 23.63 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 120.43 -1.419 . . . . 0.0 107.248 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -168.18 148.21 4.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 131.649 3.98 . . . . 0.0 104.712 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -172.68 165.57 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 mm -117.87 135.9 56.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 122.027 0.918 . . . . 0.0 108.642 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -149.09 142.74 25.48 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.221 -1.809 . . . . 0.0 108.962 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t0 51.85 33.61 11.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.871 1.268 . . . . 0.0 110.863 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 55.57 29.12 12.9 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 127.573 2.349 . . . . 0.0 112.463 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -124.6 144.01 50.4 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 m -81.88 114.43 20.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -117.76 165.7 13.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.722 2.009 . . . . 0.0 111.879 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -150.33 173.89 13.48 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.175 1.39 . . . . 0.0 109.576 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.49 128.55 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 p -90.02 163.88 14.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.943 1.297 . . . . 0.0 113.584 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -75.74 -16.78 60.09 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.221 1.809 . . . . 0.0 112.737 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -75.18 136.94 41.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.602 1.561 . . . . 0.0 106.893 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.515 ' C ' HD12 ' A' ' 33' ' ' ILE . 42.3 tt0 -118.9 147.32 44.12 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.708 1.603 . . . . 0.0 111.095 -178.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.515 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.5 mp -118.46 136.88 24.24 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.605 1.562 . . . . 0.0 107.432 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.02 156.87 26.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 124.615 3.543 . . . . 0.0 112.136 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -57.95 -28.47 64.35 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.811 0.844 . . . . 0.0 111.737 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -67.13 -14.42 62.89 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.07 -1.019 . . . . 0.0 112.119 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -104.08 -8.31 19.6 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.609 1.164 . . . . 0.0 110.889 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.65 132.38 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.703 1.601 . . . . 0.0 108.668 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.63 -56.09 3.92 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.572 1.149 . . . . 0.0 110.445 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -169.08 170.09 9.04 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.713 1.605 . . . . 0.0 109.412 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.8 p -68.97 174.03 4.86 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.7 tttp -138.92 -39.02 0.5 Allowed 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.179 -0.951 . . . . 0.0 112.407 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -149.34 117.55 0.93 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.714 0.806 . . . . 0.0 109.043 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 124.22 33.48 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 104.322 -2.473 . . . . 0.0 104.322 176.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.69 157.18 42.66 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 128.417 2.687 . . . . 0.0 105.312 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -140.59 109.7 6.14 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.413 1.085 . . . . 0.0 110.332 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -144.18 139.72 28.92 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -137.28 144.74 42.84 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 127.696 2.398 . . . . 0.0 108.256 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -154.47 169.55 23.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 61.9 mt -131.07 134.02 62.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 t -122.88 143.11 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.468 1.107 . . . . 0.0 108.282 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.08 123.86 28.74 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 106.388 -1.708 . . . . 0.0 106.388 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtp -68.24 -21.85 64.81 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 120.287 1.403 . . . . 0.0 114.018 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -74.27 -53.57 9.48 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.856 0.753 . . . . 0.0 110.364 -179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.8 m -91.92 -15.87 27.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.54 30.76 19.99 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 126.545 1.938 . . . . 0.0 111.798 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -115.59 161.09 19.13 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.633 1.173 . . . . 0.0 109.257 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.34 149.45 44.39 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.193 0.52 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 mt -129.19 173.05 10.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.33 1.852 . . . . 0.0 107.786 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 t -118.66 12.72 13.16 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.255 1.022 . . . . 0.0 111.512 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.5 p -159.07 157.75 31.7 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.827 1.194 . . . . 0.0 109.28 -179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 t -89.7 119.91 30.51 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.948 0.899 . . . . 0.0 110.098 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -130.72 160.12 35.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.314 1.045 . . . . 0.0 109.473 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -51.8 -20.72 2.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -104.32 5.71 34.73 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.807 1.639 . . . . 0.0 111.161 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 21.1 m -115.55 165.74 12.67 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 124.95 1.3 . . . . 0.0 111.203 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.8 t -140.57 144.5 27.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 124.515 1.126 . . . . 0.0 108.259 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.1 t -87.48 143.37 27.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.761 1.224 . . . . 0.0 108.89 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.0 mt -136.78 122.88 20.34 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.9 t -104.88 103.29 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 103.556 -2.757 . . . . 0.0 103.556 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.02 97.48 10.74 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -166.94 -172.92 2.2 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 44.22 68.96 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.939 1.696 . . . . 0.0 114.79 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.8 mt -71.03 141.14 17.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.73 1.612 . . . . 0.0 109.223 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -131.44 169.43 16.06 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.171 1.788 . . . . 0.0 109.341 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -114.85 152.79 31.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.207 1.403 . . . . 0.0 107.546 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.09 160.74 14.59 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.947 1.299 . . . . 0.0 109.824 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -65.07 -24.68 67.53 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.238 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -85.7 12.85 8.04 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 126.588 1.955 . . . . 0.0 110.662 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 69.75 -1.82 2.19 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.917 2.087 . . . . 0.0 110.524 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.0 m -70.97 168.69 16.45 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.4 148.8 45.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.909 0.884 . . . . 0.0 111.177 -178.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 21.1 p -141.94 172.06 13.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.151 0.98 . . . . 0.0 111.019 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.4 ttm -133.05 139.71 47.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 126.121 1.768 . . . . 0.0 109.365 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.59 124.3 6.64 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.5 mt -141.98 123.03 12.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 49.27 44.89 23.61 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.573 1.149 . . . . 0.0 110.871 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.6 t0 67.11 4.27 3.54 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.961 2.905 . . . . 0.0 116.142 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -111.81 145.89 38.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.903 1.281 . . . . 0.0 108.907 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -98.86 117.91 34.43 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 123.034 0.534 . . . . 0.0 111.656 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -105.95 132.15 52.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.685 1.194 . . . . 0.0 107.808 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HE2' HD21 ' A' ' 94' ' ' LEU . 1.4 ttpm? -72.1 158.54 35.75 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 118.596 -1.242 . . . . 0.0 110.336 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.63 133.56 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.625 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.5 mm? -127.04 163.51 41.18 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 125.991 1.716 . . . . 0.0 110.736 -177.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.76 143.3 26.6 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.296 1.997 . . . . 0.0 107.859 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -12.64 20.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.3 m -65.77 -13.81 60.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -76.1 -1.24 25.11 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.362 1.065 . . . . 0.0 112.382 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -50.46 149.77 2.96 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.506 1.122 . . . . 0.0 109.273 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.62 -42.33 2.91 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.45 -39.56 13.28 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.568 0.747 . . . . 0.0 108.986 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -130.44 170.79 18.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 125.798 1.639 . . . . 0.0 109.6 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -145.25 166.34 25.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.469 2.308 . . . . 0.0 108.186 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.42 174.24 5.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.445 0.641 . . . . 0.0 110.792 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.292 0.4 OUTLIER -68.99 176.17 3.3 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.134 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ptp85 -129.92 141.47 50.78 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 125.157 1.383 . . . . 0.0 112.229 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.0 mp -71.63 -17.95 62.23 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.248 0.619 . . . . 0.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -57.8 -26.53 62.08 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.082 1.753 . . . . 0.0 113.484 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -76.63 -9.43 58.66 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.772 0.829 . . . . 0.0 110.446 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 121.574 0.702 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -161.27 158.27 26.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.474 1.91 . . . . 0.0 107.206 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.4 m 53.68 78.55 0.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.621 1.568 . . . . 0.0 109.811 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 84.4 p -137.48 97.0 3.36 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -70.35 114.56 8.6 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -142.12 179.16 7.06 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.267 1.827 . . . . 0.0 107.93 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 tptt -147.72 161.33 41.42 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.2 t -119.78 139.92 45.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 120.707 1.594 . . . . 0.0 108.798 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -107.18 118.41 36.65 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -84.66 175.42 9.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -80.84 -34.13 34.04 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 127.417 2.287 . . . . 0.0 110.459 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 54.13 127.64 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 128.465 2.706 . . . . 0.0 115.042 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.98 25.23 61.57 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.363 -0.836 . . . . 0.0 112.577 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 m -140.49 -179.62 6.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 126.95 2.1 . . . . 0.0 110.785 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -73.69 -171.06 0.96 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.491 1.516 . . . . 0.0 109.005 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.7 p -80.53 120.76 24.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 119.511 -1.993 . . . . 0.0 111.626 -175.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -167.16 154.9 9.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.44 3.896 . . . . 0.0 105.294 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 49.0 p90 -170.11 173.49 5.88 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.693 1.588 . . . . 0.0 107.437 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.1 mt -131.58 119.01 41.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 O-C-N 120.529 -1.357 . . . . 0.0 107.496 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -129.38 137.8 51.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.28 34.12 22.13 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.796 1.239 . . . . 0.0 111.438 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.7 m120 62.98 14.99 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.452 2.701 . . . . 0.0 112.931 -178.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -111.62 132.94 54.22 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.8 m -76.32 129.06 36.08 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.0 m-85 -132.84 164.1 27.63 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 126.603 1.961 . . . . 0.0 110.516 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -149.25 159.37 44.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 109.442 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 t -89.72 132.23 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.4 p -102.04 166.3 10.69 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.732 1.213 . . . . 0.0 110.091 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.1 -7.69 55.32 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.342 1.057 . . . . 0.0 112.122 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -71.28 114.22 9.12 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -101.99 144.11 31.01 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.07 140.01 23.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.863 2.065 . . . . 0.0 108.403 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.77 156.15 39.56 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 123.016 2.477 . . . . 0.0 109.89 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.53 -29.47 69.14 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.12 -19.5 65.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.074 0.55 . . . . 0.0 111.936 179.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -93.17 -13.57 28.24 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.592 0.757 . . . . 0.0 110.28 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 65.7 t -75.2 123.5 31.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -80.24 -61.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.44 163.99 38.79 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.253 -0.904 . . . . 0.0 112.351 -178.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 m -65.5 137.26 57.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.601 1.56 . . . . 0.0 107.152 178.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' OE2' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -112.29 -53.87 2.67 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.883 -177.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.1 t -141.01 134.39 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 119.814 1.188 . . . . 0.0 112.547 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.3 mtpt -103.53 110.21 22.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.05 156.75 44.1 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.445 2.698 . . . . 0.0 106.493 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -128.31 113.18 15.3 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.844 0.857 . . . . 0.0 110.723 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.88 134.41 18.63 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.954 0.797 . . . . 0.0 110.468 178.263 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.478 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 9.0 tt -138.32 145.04 40.69 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.85 1.66 . . . . 0.0 108.283 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -148.75 170.39 18.32 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.099 1.36 . . . . 0.0 107.402 179.266 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.431 ' O ' HD13 ' A' ' 58' ' ' LEU . 50.9 mt -129.48 132.21 66.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.3 t -126.72 139.74 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.649 1.18 . . . . 0.0 109.458 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -85.99 128.36 34.83 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.309 -0.87 . . . . 0.0 109.406 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 46.9 mtp -68.64 -19.44 64.42 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttm -77.16 -46.85 22.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.519 1.509 . . . . 0.0 111.952 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.0 p -105.2 -6.06 20.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 63.88 18.81 11.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.695 1.198 . . . . 0.0 110.378 -179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -101.72 159.91 14.91 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.342 0.974 . . . . 0.0 111.739 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.8 mm? -73.2 145.76 46.03 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.415 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 mt -126.6 166.32 17.53 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.893 2.077 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.83 -33.55 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.612 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.5 m -130.02 150.01 51.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.461 1.104 . . . . 0.0 109.551 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.92 111.09 17.79 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.495 0.718 . . . . 0.0 110.506 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -101.8 168.69 9.28 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 177.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -58.11 -32.66 68.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -78.53 -3.05 41.73 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.071 0.948 . . . . 0.0 110.445 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.4 t -114.58 161.66 17.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.393 1.477 . . . . 0.0 113.219 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.3 t -133.88 146.46 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 126.125 1.77 . . . . 0.0 108.431 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.29 144.19 29.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.966 1.306 . . . . 0.0 109.554 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.7 mt -135.37 122.53 21.53 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.865 -1.147 . . . . 0.0 108.162 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.443 HG22 HD12 ' A' ' 48' ' ' LEU . 3.5 t -106.71 103.41 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -99.36 96.64 7.85 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.124 -1.806 . . . . 0.0 106.124 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -170.22 -168.91 0.78 Allowed 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 50.06 68.31 0.77 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.88 1.272 . . . . 0.0 112.912 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.74 145.33 11.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.638 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -135.87 169.01 18.26 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.926 2.09 . . . . 0.0 109.064 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.424 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 tt0 -119.16 149.66 41.35 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.482 1.513 . . . . 0.0 107.071 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.56 166.58 10.64 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.593 1.557 . . . . 0.0 110.255 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.2 p -61.2 -29.95 70.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.911 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -101.58 29.47 4.85 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.995 1.718 . . . . 0.0 112.885 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 65.76 -0.82 1.19 Allowed 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.631 1.972 . . . . 0.0 114.055 178.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -67.15 158.89 30.12 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.0 mt -115.62 144.43 43.91 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -138.76 164.88 28.44 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.8 ttm -127.7 137.35 52.45 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.317 1.847 . . . . 0.0 109.524 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.44 117.94 4.52 Favored Glycine 0 CA--C 1.521 0.438 0 C-N-CA 124.71 1.148 . . . . 0.0 110.393 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.8 mt -134.83 118.79 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 125.505 1.522 . . . . 0.0 107.101 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.6 m120 49.94 47.21 23.56 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.481 1.113 . . . . 0.0 109.754 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 65.18 9.38 5.53 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.165 2.186 . . . . 0.0 114.733 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -115.48 136.95 52.56 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.164 1.386 . . . . 0.0 108.737 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -92.64 117.35 29.88 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.97 -0.456 . . . . 0.0 111.156 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 132.17 52.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.135 -0.978 . . . . 0.0 108.778 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 147.54 51.66 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -115.62 132.62 64.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -124.32 157.38 64.86 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 124.824 1.25 . . . . 0.0 108.775 -178.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.9 154.39 67.24 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.659 2.239 . . . . 0.0 109.685 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -61.04 -15.19 29.51 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.808 0.337 . . . . 0.0 111.631 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.3 p -80.05 -7.73 59.01 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 112.242 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -87.5 -9.58 54.14 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.696 1.598 . . . . 0.0 112.14 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.51 161.83 0.93 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.728 1.211 . . . . 0.0 113.492 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.78 -42.59 2.65 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 107.941 -2.064 . . . . 0.0 107.941 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.18 -27.62 22.92 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.194 0.998 . . . . 0.0 109.396 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.6 p -132.6 166.64 28.69 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.554 1.542 . . . . 0.0 109.882 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -135.94 165.19 26.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.841 2.456 . . . . 0.0 107.363 178.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.98 178.93 0.58 Allowed 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.452 0.644 . . . . 0.0 111.083 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.578 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -70.9 170.23 13.1 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.822 -0.549 . . . . 0.0 109.721 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.578 ' N ' HD12 ' A' ' 105' ' ' LEU . 88.2 mtt180 -126.02 142.18 51.63 Favored 'General case' 0 CA--C 1.52 -0.199 0 O-C-N 121.166 -0.959 . . . . 0.0 110.11 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.4 -17.24 62.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.766 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.68 -18.07 61.74 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -73.15 -13.93 61.27 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.679 0.672 . . . . 0.0 111.784 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 C--O 1.248 0.988 0 C-N-CA 126.369 1.867 . . . . 0.0 110.342 -177.543 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 . . . . . 0 N--CA 1.474 0.775 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 75.5 41.41 0.27 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.13 2.572 . . . . 0.0 115.064 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.16 137.4 41.31 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.5 m -151.39 121.38 7.13 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.156 1.383 . . . . 0.0 107.982 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -129.72 120.11 24.58 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.983 1.313 . . . . 0.0 109.061 -179.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -162.73 152.74 16.14 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.658 -1.276 . . . . 0.0 110.803 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -67.86 163.76 21.2 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.4 t -116.44 160.27 15.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.039 1.335 . . . . 0.0 108.608 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -128.46 107.69 9.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 102.821 -3.029 . . . . 0.0 102.821 178.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -82.36 166.63 19.29 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -33.98 76.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.158 0.89 . . . . 0.0 110.801 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 55.66 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.606 1.962 . . . . 0.0 113.424 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.51 7.3 51.71 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.819 1.199 . . . . 0.0 112.477 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 m -131.96 179.31 6.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.112 1.765 . . . . 0.0 110.031 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -73.4 -169.74 0.7 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.118 2.167 . . . . 0.0 107.778 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.0 p -80.71 120.31 24.44 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 120.068 -1.645 . . . . 0.0 111.708 -176.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -168.82 147.12 3.99 Favored 'General case' 0 CA--C 1.54 0.573 1 C-N-CA 133.622 4.769 . . . . 0.0 103.224 177.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 44.9 p90 -165.55 169.17 15.74 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 125.311 1.444 . . . . 0.0 107.83 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 20' ' ' ILE . 2.5 mp -123.52 123.02 66.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 O-C-N 120.472 -1.393 . . . . 0.0 108.014 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -133.09 139.2 47.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t70 54.03 33.23 17.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.506 1.522 . . . . 0.0 112.626 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 65.27 24.02 12.19 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.33 1.452 . . . . 0.0 110.486 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -125.13 137.23 54.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.34 144.59 40.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.545 -2.021 . . . . 0.0 105.545 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.6 m-85 -147.99 167.45 24.88 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 127.032 2.133 . . . . 0.0 110.472 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -150.02 171.29 17.08 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.041 0.937 . . . . 0.0 108.761 177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.96 127.53 58.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -94.9 169.19 10.31 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.467 1.107 . . . . 0.0 110.472 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.24 -15.52 58.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.937 1.295 . . . . 0.0 112.817 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 111.96 6.38 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.333 0.653 . . . . 0.0 111.196 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -93.6 140.18 29.91 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.438 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.7 mp -111.67 141.32 24.43 Favored Pre-proline 0 N--CA 1.466 0.358 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.65 151.47 41.45 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.7 1.6 . . . . 0.0 111.194 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -53.97 -29.06 41.3 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.737 1.615 . . . . 0.0 113.263 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -69.89 -29.09 66.2 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 123.289 0.636 . . . . 0.0 110.864 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -84.91 -15.57 44.03 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.797 0.839 . . . . 0.0 110.666 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.32 138.8 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -92.8 -61.57 1.56 Allowed 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.34 166.49 18.61 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.086 0.857 . . . . 0.0 112.245 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.7 m -63.69 138.76 58.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.599 1.16 . . . . 0.0 109.069 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -116.27 -36.34 4.07 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -148.76 142.8 18.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -117.83 102.34 9.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -135.67 157.81 45.94 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 130.419 3.488 . . . . 0.0 106.577 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -141.45 110.45 6.21 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.103 1.361 . . . . 0.0 107.608 179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -141.1 125.53 17.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 tt -125.34 144.39 50.52 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.555 1.542 . . . . 0.0 107.749 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -153.45 169.95 21.92 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 108.948 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.571 ' O ' HD13 ' A' ' 58' ' ' LEU . 31.8 mt -124.29 138.41 53.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 125.613 1.565 . . . . 0.0 106.785 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.6 t -132.77 124.82 51.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.429 1.092 . . . . 0.0 109.977 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -62.19 121.65 13.62 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.664 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.3 mtp -68.2 -18.24 64.53 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 120.71 1.596 . . . . 0.0 112.546 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -84.18 -25.69 29.36 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -122.35 -13.43 8.06 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.273 0.629 . . . . 0.0 111.802 -178.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 63.65 21.27 12.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.605 1.562 . . . . 0.0 109.901 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -105.18 153.15 21.94 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.61 1.164 . . . . 0.0 110.783 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -67.34 148.22 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.958 0.903 . . . . 0.0 110.856 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.5 mt -136.04 177.28 7.96 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.004 1.722 . . . . 0.0 109.392 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.3 p -105.65 -30.36 9.53 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.144 1.377 . . . . 0.0 111.088 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -122.03 151.89 40.35 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.005 0.82 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -89.07 93.28 9.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.243 0.617 . . . . 0.0 109.551 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.69 164.39 18.63 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -57.33 -34.24 68.55 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -80.72 5.39 15.88 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.642 -0.661 . . . . 0.0 111.584 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.4 t -113.42 177.99 4.44 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.201 1.4 . . . . 0.0 111.634 -178.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 p -145.85 159.19 12.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 126.686 1.994 . . . . 0.0 107.419 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.23 143.14 42.46 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.0 mt -131.33 150.87 51.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 t -127.86 102.65 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -86.14 92.03 8.61 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.29 -173.02 3.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 47.3 67.63 0.77 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.874 1.67 . . . . 0.0 112.882 177.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mt -77.9 141.81 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 O-C-N 121.177 -0.952 . . . . 0.0 109.498 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -140.87 166.11 25.69 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.942 1.697 . . . . 0.0 110.039 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -110.9 158.04 19.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.918 2.087 . . . . 0.0 106.952 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.94 168.78 9.77 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.544 1.138 . . . . 0.0 112.27 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -58.06 -35.89 72.0 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.91 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -84.89 21.13 1.65 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.684 1.193 . . . . 0.0 111.785 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.8 mptt 59.1 19.68 7.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.306 1.443 . . . . 0.0 110.721 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.543 ' HB3' ' HE2' ' A' ' 92' ' ' LYS . 63.3 m -79.69 168.68 19.03 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mt -125.46 143.59 50.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.5 p -147.84 168.64 21.68 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.608 0.763 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.0 ttm -135.23 139.54 44.56 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.181 1.792 . . . . 0.0 109.733 -178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.1 6.98 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.9 mt -138.72 124.42 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 52.07 42.53 30.55 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.826 0.822 . . . . 0.0 109.004 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 60.44 20.86 10.52 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.834 2.054 . . . . 0.0 114.105 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 -122.07 137.66 54.73 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.712 1.605 . . . . 0.0 108.477 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -93.27 116.32 28.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -106.52 129.83 54.41 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.536 1.135 . . . . 0.0 110.754 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.543 ' HE2' ' HB3' ' A' ' 81' ' ' SER . 51.1 tttm -64.28 145.36 56.14 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.621 -0.674 . . . . 0.0 109.878 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.52 133.09 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -120.13 156.64 54.6 Favored Pre-proline 0 C--O 1.238 0.468 0 C-N-CA 124.128 0.971 . . . . 0.0 109.342 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.02 141.88 54.61 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 N-CA-C 106.726 -2.067 . . . . 0.0 106.726 179.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -22.1 37.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.673 -0.642 . . . . 0.0 111.668 -179.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 t -66.16 -13.17 59.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.129 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -3.16 43.56 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 120.563 1.529 . . . . 0.0 114.098 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -50.85 162.01 0.31 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.24 1.416 . . . . 0.0 113.794 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.84 -43.65 2.98 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 127.074 2.274 . . . . 0.0 110.969 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.89 -22.54 45.8 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -133.05 159.23 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 C-N-CA 130.78 3.632 . . . . 0.0 106.1 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -135.6 169.42 17.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 123.461 0.704 . . . . 0.0 109.953 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.84 160.29 17.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.71 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.527 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.2 158.6 8.72 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.937 0.875 . . . . 0.0 112.774 -178.83 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.527 ' N ' HD12 ' A' ' 105' ' ' LEU . 9.4 mtt85 -109.94 119.24 38.7 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 124.744 1.217 . . . . 0.0 108.551 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -9.35 43.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.937 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.62 -22.12 66.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.452 1.101 . . . . 0.0 110.959 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -70.24 -9.04 54.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.646 1.178 . . . . 0.0 113.356 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 125.018 1.327 . . . . 0.0 110.178 -178.078 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.811 0.338 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.1 t -80.52 133.4 29.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -103.23 111.9 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -89.61 149.74 22.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -62.62 -34.97 78.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.845 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 65.27 138.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.89 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.69 25.47 9.17 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.479 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.29 -175.91 4.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.363 . . . . 0.0 110.847 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -165.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.434 HG21 HD23 ' A' ' 105' ' ' LEU . 22.2 p -75.67 116.75 16.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.142 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -171.54 153.46 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.679 ' HZ ' HD12 ' A' ' 93' ' ' ILE . 9.8 p90 -174.9 158.1 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.886 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 84.8 mt -120.27 127.97 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -131.18 130.68 43.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t0 63.74 35.64 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.838 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 63.89 30.4 14.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.872 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -134.28 133.87 41.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -64.97 144.16 57.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.876 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 95' ' ' PRO . 5.7 m-85 -154.33 157.22 38.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 29' ' ' THR . 35.1 p90 -149.24 163.5 37.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 86' ' ' ILE . 21.7 t -88.77 127.33 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.164 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.52 HG22 ' CE2' ' A' ' 27' ' ' PHE . 19.1 p -97.78 165.19 12.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.14 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -73.04 -17.41 61.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.853 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.72 126.61 28.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.857 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.433 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.4 tt0 -110.24 140.39 44.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.433 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -113.13 134.4 21.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.59 0.709 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 147.4 62.32 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.644 2.23 . . . . 0.0 112.388 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -54.89 -31.62 60.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.923 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -62.67 -21.95 66.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -93.41 -20.44 20.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -70.56 135.78 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.143 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -85.41 -57.34 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.67 178.33 3.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.0 p -55.76 161.22 2.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HE2' HD12 ' A' ' 82' ' ' LEU . 12.3 tttm -131.85 -51.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.913 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.5 t -150.57 141.97 16.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.079 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -106.66 114.45 28.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -148.68 156.89 43.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -125.65 107.97 11.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE3' HD23 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -142.2 126.0 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.869 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 tt -138.08 138.98 39.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.644 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -152.18 169.39 22.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.731 ' O ' HD13 ' A' ' 58' ' ' LEU . 21.4 mt -122.82 135.79 61.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.085 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.735 HG22 HD22 ' A' ' 58' ' ' LEU . 14.1 t -129.52 137.5 56.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.094 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.631 ' OD2' HD11 ' A' ' 59' ' ' LEU . 2.0 t70 -86.12 123.26 31.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.4 mtp -69.17 -9.95 55.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.06 -54.2 28.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.955 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -122.15 10.03 9.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 55.94 35.94 26.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -111.48 158.2 19.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.735 HD22 HG22 ' A' ' 51' ' ' VAL . 2.1 mm? -76.14 152.25 36.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.896 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.631 HD11 ' OD2' ' A' ' 52' ' ' ASP . 64.4 mt -129.84 -172.63 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.943 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -114.48 -16.13 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 p -134.78 176.85 8.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.2 t -107.57 108.55 19.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.8 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -107.8 173.43 6.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -67.87 -29.18 68.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-20 -91.48 13.25 18.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.484 ' OG ' HG22 ' A' ' 50' ' ' ILE . 28.4 t -130.98 158.32 40.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.6 t -133.58 135.76 55.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.5 t -77.96 140.45 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.114 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.738 HD11 HD23 ' A' ' 107' ' ' LEU . 11.4 mt -131.91 131.09 42.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.631 HG12 ' ND2' ' A' ' 72' ' ' ASN . 14.4 t -112.83 103.96 16.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.142 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.6 HD21 HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -94.67 96.58 9.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.631 ' ND2' HG12 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -175.94 -168.9 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.868 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 68.01 0.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 83' ' ' CYS . 13.3 mt -81.24 141.24 15.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.75 168.83 18.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -106.49 163.56 12.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.59 168.01 11.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.099 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -68.26 -27.61 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -95.61 26.6 3.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.888 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt 64.22 15.52 9.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.8 m -82.59 146.46 29.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.834 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.449 ' N ' HD22 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -103.5 149.64 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.424 ' O ' HG23 ' A' ' 74' ' ' ILE . 20.7 p -151.14 162.72 40.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.4 ttm -126.14 150.06 48.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.822 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -87.29 128.24 8.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.507 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.429 ' CD1' HG11 ' A' ' 28' ' ' VAL . 39.7 mt -146.2 111.86 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.811 0.338 . . . . 0.0 111.115 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 59.17 47.52 11.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 63.7 16.25 9.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -127.44 124.15 37.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -85.72 117.54 24.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -109.14 130.7 55.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.34 48.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.905 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.679 HD12 ' HZ ' ' A' ' 19' ' ' PHE . 4.7 pt -118.24 133.5 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.105 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 93' ' ' ILE . 4.6 mm? -127.16 159.46 64.94 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.622 0.725 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 53.6 Cg_endo -69.76 148.87 65.99 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 0.0 112.361 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -59.93 -20.14 55.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 49.5 m -69.23 -17.28 63.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -0.43 41.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -51.17 165.97 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 96.93 -41.47 2.34 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.5 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.41 -21.31 11.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.865 0.364 . . . . 0.0 111.116 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.13 146.68 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.163 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -129.45 166.33 19.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.947 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.48 168.02 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.095 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.612 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -68.52 164.89 20.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.612 ' N ' HD12 ' A' ' 105' ' ' LEU . 21.4 mtt85 -111.93 139.41 47.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.738 HD23 HD11 ' A' ' 69' ' ' LEU . 0.5 OUTLIER -71.65 -14.83 62.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.921 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -62.22 -17.06 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -78.78 -2.95 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . 0.997 ' O ' ' C ' ' A' ' 110' ' ' PHE . 22.5 m-85 . . . . . 1 C--O 2.0 40.583 1 CA-C-O 161.141 19.543 . . . . 0.0 110.877 179.99 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 tttt . . . . . 0 C--O 1.24 0.579 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 t -129.61 140.15 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 105.785 -1.932 . . . . 0.0 105.785 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -103.3 118.26 36.36 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.22 146.08 24.59 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -62.35 -34.87 77.51 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 64.28 133.59 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.702 2.001 . . . . 0.0 111.846 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.51 19.59 58.05 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.073 -1.017 . . . . 0.0 112.1 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.11 178.07 7.35 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.855 2.062 . . . . 0.0 109.983 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -169.56 0.78 Allowed 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.372 2.269 . . . . 0.0 107.771 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.2 p -79.96 120.74 24.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.378 -1.451 . . . . 0.0 107.743 -176.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -167.66 138.85 2.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.399 3.08 . . . . 0.0 106.117 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 35.9 p90 -162.15 177.94 9.23 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 123.561 0.744 . . . . 0.0 109.749 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 mt -137.93 122.92 23.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 C-N-CA 123.624 0.77 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 71.6 t80 -131.65 142.94 49.97 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.44 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 23.4 t70 56.32 34.31 23.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.809 1.244 . . . . 0.0 108.852 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 m120 62.35 12.05 4.98 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.254 2.222 . . . . 0.0 112.289 -178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.36 146.47 39.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 119.223 0.92 . . . . 0.0 109.235 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.1 m -75.38 133.48 41.18 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.302 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.6 m-85 -141.84 162.09 36.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.611 1.565 . . . . 0.0 109.123 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -148.56 161.73 41.08 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 121.031 -1.043 . . . . 0.0 108.619 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.79 130.76 40.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -100.19 169.83 8.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.128 0.971 . . . . 0.0 111.385 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.76 -14.63 61.15 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 126.935 2.094 . . . . 0.0 111.797 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -69.91 124.36 23.83 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 124.801 1.24 . . . . 0.0 109.693 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.32 144.74 40.02 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.421 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -123.74 138.7 30.85 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.384 1.474 . . . . 0.0 107.807 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.33 153.51 50.72 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.392 2.061 . . . . 0.0 112.646 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -50.39 -33.84 22.1 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 126.298 1.839 . . . . 0.0 114.45 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.499 ' HG3' HD22 ' A' ' 37' ' ' ASN . 5.8 pt-20 -67.82 -27.56 66.83 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.344 0.658 . . . . 0.0 111.625 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.499 HD22 ' HG3' ' A' ' 36' ' ' GLU . 1.9 m-80 -82.45 -24.76 34.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -67.13 119.51 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -74.21 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.58 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.62 172.37 15.48 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.06 0.544 . . . . 0.0 111.2 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.1 t -60.74 157.86 13.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.411 1.484 . . . . 0.0 108.722 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.544 ' HE2' ' CD1' ' A' ' 82' ' ' LEU . 3.7 tttp -133.43 -51.22 0.87 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 117.498 -1.239 . . . . 0.0 111.299 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -144.28 112.05 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.258 0.936 . . . . 0.0 111.408 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -84.41 92.62 8.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.41 156.65 38.5 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 130.019 3.328 . . . . 0.0 105.981 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -135.93 121.63 19.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.714 1.605 . . . . 0.0 110.145 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.482 ' CE ' HD23 ' A' ' 49' ' ' LEU . 3.7 tmtm? -147.45 132.77 18.5 Favored 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tt -134.45 143.23 47.41 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 126.924 2.09 . . . . 0.0 106.249 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.482 HD23 ' CE ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -157.61 167.56 29.79 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.747 1.619 . . . . 0.0 107.695 178.113 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.5 mt -126.62 127.42 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.0 t -112.48 139.85 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.069 1.347 . . . . 0.0 109.584 -179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -87.01 120.86 28.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.153 1.381 . . . . 0.0 108.507 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.6 mtp -64.72 -21.07 66.67 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -77.01 -53.49 7.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 120.967 1.712 . . . . 0.0 111.937 -179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.5 m -96.9 -6.51 35.58 Favored 'General case' 0 CA--C 1.523 -0.072 0 CA-C-O 118.097 -0.954 . . . . 0.0 113.394 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 65.15 21.9 12.2 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -101.22 157.43 16.78 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 124.823 1.249 . . . . 0.0 111.088 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.82 152.83 33.26 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.409 ' CD1' HD22 ' A' ' 63' ' ' ASN . 69.0 mt -127.21 169.09 13.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.128 0.971 . . . . 0.0 109.814 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.2 p -109.99 11.56 23.96 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 126.988 2.115 . . . . 0.0 108.991 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.3 p -155.0 169.23 24.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.045 1.338 . . . . 0.0 111.714 -179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.8 t -101.62 110.84 22.91 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.409 HD22 ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -117.64 157.2 26.85 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.573 0.749 . . . . 0.0 109.206 178.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -32.25 69.94 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.628 1.558 . . . . 0.0 113.704 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -85.02 15.43 4.07 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.353 1.061 . . . . 0.0 109.896 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 p -120.88 162.85 19.12 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.676 1.19 . . . . 0.0 110.55 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.5 t -137.77 130.63 41.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.3 t -80.25 134.09 36.06 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 106.039 -1.838 . . . . 0.0 106.039 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.3 125.51 43.63 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 t -104.69 103.01 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 102.879 -3.008 . . . . 0.0 102.879 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -96.34 91.86 6.05 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -168.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -175.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 48.07 67.17 0.88 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.825 1.25 . . . . 0.0 111.598 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -72.02 144.9 12.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.932 1.293 . . . . 0.0 111.697 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -138.25 169.25 18.12 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.295 2.238 . . . . 0.0 110.403 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -117.15 162.71 17.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.123 2.169 . . . . 0.0 108.139 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.15 175.41 6.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.396 1.878 . . . . 0.0 111.358 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -53.27 -48.04 68.63 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.03 1.732 . . . . 0.0 111.754 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -85.48 18.86 2.56 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.083 -1.01 . . . . 0.0 111.936 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.11 8.91 5.98 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.534 1.933 . . . . 0.0 109.723 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -64.52 157.03 27.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.544 ' CD1' ' HE2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -116.17 155.28 28.54 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.334 -0.854 . . . . 0.0 111.361 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.9 p -151.54 168.89 23.51 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.6 ttm -135.98 143.65 44.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.724 1.609 . . . . 0.0 109.737 -178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.73 125.37 7.03 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 109.796 -1.321 . . . . 0.0 109.796 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mt -143.38 121.73 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 50.84 35.72 12.92 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.574 0.75 . . . . 0.0 111.084 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 74.63 12.51 3.75 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 126.17 1.788 . . . . 0.0 114.31 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -120.04 135.64 54.86 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.639 1.175 . . . . 0.0 109.006 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -88.86 115.83 26.7 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.476 0.711 . . . . 0.0 110.591 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -109.18 131.54 54.97 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.517 1.127 . . . . 0.0 111.247 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.421 ' HB2' HD13 ' A' ' 33' ' ' ILE . 10.6 ttpt -65.77 148.74 51.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.977 0.911 . . . . 0.0 110.31 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.414 HD11 ' HB3' ' A' ' 82' ' ' LEU . 1.3 pt -117.65 133.04 65.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -121.61 159.72 49.45 Favored Pre-proline 0 N--CA 1.467 0.405 0 C-N-CA 125.575 1.55 . . . . 0.0 109.21 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -71.98 151.36 56.13 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.07 1.847 . . . . 0.0 109.022 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.01 -5.68 5.01 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 p -80.16 -23.68 40.9 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.133 1.373 . . . . 0.0 111.181 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -72.31 -0.26 11.8 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.305 1.842 . . . . 0.0 114.539 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.1 mmtt -51.85 157.09 1.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.976 1.311 . . . . 0.0 111.272 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.1 -26.37 17.41 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.465 1.031 . . . . 0.0 111.483 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.03 -12.44 11.97 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.15 1.38 . . . . 0.0 110.149 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.8 p -150.26 150.27 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 C-N-CA 124.743 1.217 . . . . 0.0 108.127 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -129.82 173.0 11.08 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.895 2.478 . . . . 0.0 105.336 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 166.35 5.38 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.867 0.841 . . . . 0.0 111.043 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -61.58 162.48 8.25 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.012 0.925 . . . . 0.0 110.162 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.572 ' N ' HD12 ' A' ' 105' ' ' LEU . 86.2 mtt180 -111.5 138.82 47.52 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.445 0.698 . . . . 0.0 112.169 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.437 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.1 OUTLIER -70.61 -16.4 62.83 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.172 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -67.61 -3.82 10.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.637 1.175 . . . . 0.0 112.855 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -90.73 4.2 52.21 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 120.858 -1.152 . . . . 0.0 110.251 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 126.437 1.895 . . . . 0.0 107.994 -178.803 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 t -107.32 136.98 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.7 119.12 38.46 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 106.147 -1.798 . . . . 0.0 106.147 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -93.54 172.21 8.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.871 1.268 . . . . 0.0 110.125 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -65.02 -25.4 67.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 128.39 2.676 . . . . 0.0 114.695 178.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 45.12 92.96 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.919 2.087 . . . . 0.0 114.264 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 31.55 50.52 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 113.325 -1.761 . . . . 0.0 113.18 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -136.01 -178.96 5.38 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 127.392 2.277 . . . . 0.0 110.434 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.99 -170.99 0.8 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.873 1.269 . . . . 0.0 108.404 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -79.13 120.44 23.66 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.783 -1.823 . . . . 0.0 110.274 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -168.99 145.47 3.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.014 2.926 . . . . 0.0 107.421 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.475 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 45.4 p90 -165.15 166.42 19.03 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mp -123.16 121.87 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 120.886 -1.134 . . . . 0.0 108.715 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -131.82 140.31 49.11 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 55.23 36.69 27.56 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.29 1.036 . . . . 0.0 110.72 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 m120 59.49 18.91 7.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.886 1.674 . . . . 0.0 112.753 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.95 140.01 50.7 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 126.273 1.829 . . . . 0.0 106.148 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 m -80.0 140.51 36.56 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.5 m-85 -140.83 162.83 34.5 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.479 1.912 . . . . 0.0 110.72 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CD1' ' HE2' ' A' ' 99' ' ' LYS . 47.6 p90 -149.46 159.78 44.01 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.9 1.28 . . . . 0.0 109.64 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.5 t -89.06 133.47 31.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -99.67 169.95 8.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.206 1.003 . . . . 0.0 111.454 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -71.95 -21.01 61.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.64 2.776 . . . . 0.0 112.751 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 126.45 30.75 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.336 1.454 . . . . 0.0 112.711 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -99.31 147.68 24.94 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.82 2.048 . . . . 0.0 109.418 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.411 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -114.3 127.41 26.85 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.26 148.1 79.62 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 121.57 1.513 . . . . 0.0 110.666 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.74 -27.22 49.45 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -72.02 -19.79 61.8 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.441 0.696 . . . . 0.0 111.94 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -90.55 -21.66 21.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.72 -0.612 . . . . 0.0 110.102 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 82.5 t -59.49 137.26 22.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 124.905 1.282 . . . . 0.0 107.736 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.452 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.1 OUTLIER -91.12 -61.66 1.61 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 118.538 -0.744 . . . . 0.0 109.16 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -161.29 167.56 25.67 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.049 0.84 . . . . 0.0 112.057 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 36.9 m -69.4 133.79 48.22 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.769 1.228 . . . . 0.0 108.741 178.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -57.02 2.09 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 117.697 -1.145 . . . . 0.0 111.902 -178.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.1 t -141.0 121.99 13.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -84.98 117.6 24.06 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 105.025 -2.213 . . . . 0.0 105.025 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.19 159.74 43.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 128.584 2.754 . . . . 0.0 109.541 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -141.33 121.4 13.74 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.112 -0.992 . . . . 0.0 108.908 177.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 48' ' ' LEU . 2.1 tmtm? -148.14 137.44 22.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.463 ' N ' ' HD3' ' A' ' 47' ' ' LYS . 8.3 tt -134.93 143.29 46.82 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.775 2.03 . . . . 0.0 108.211 177.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -155.69 170.0 23.04 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.439 1.496 . . . . 0.0 109.539 177.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 mt -129.46 129.76 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.3 t -128.36 134.04 65.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.473 1.109 . . . . 0.0 111.04 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -71.13 117.52 12.75 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 128.12 2.568 . . . . 0.0 108.06 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.6 mtp -67.83 -23.27 65.15 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.833 1.197 . . . . 0.0 113.314 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -69.61 -53.37 19.15 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.972 0.805 . . . . 0.0 110.21 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.1 m -106.78 -2.93 20.98 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 117.07 2.248 . . . . 0.0 117.07 -177.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 59.05 35.08 23.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.823 1.249 . . . . 0.0 112.128 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -116.73 148.37 41.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.482 1.113 . . . . 0.0 109.289 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.7 155.05 40.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 79.1 mt -131.3 170.59 14.4 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 109.807 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.4 p -92.36 -27.48 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.669 1.187 . . . . 0.0 112.714 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.0 m -135.83 163.33 30.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.06 1.344 . . . . 0.0 110.392 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -88.11 109.74 20.11 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.453 1.501 . . . . 0.0 110.166 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -119.09 157.95 26.83 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -55.81 -18.75 9.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -92.04 7.8 40.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 119.538 1.063 . . . . 0.0 110.356 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 t -133.83 166.89 21.61 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.473 1.909 . . . . 0.0 111.041 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -142.2 156.21 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.99 1.716 . . . . 0.0 107.878 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.2 t -105.69 143.9 33.19 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.27 1.428 . . . . 0.0 108.577 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.44 133.69 44.17 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.0 t -104.52 102.3 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 103.846 -2.65 . . . . 0.0 103.846 178.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -82.83 95.62 7.97 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.55 -173.42 3.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 47.27 68.77 0.59 Allowed 'General case' 0 C--N 1.342 0.248 0 C-N-CA 127.694 2.398 . . . . 0.0 112.705 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.5 mt -72.45 140.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 44.5 m-85 -134.64 170.27 16.05 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 127.284 2.233 . . . . 0.0 109.218 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.65 152.62 34.82 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 126.077 1.751 . . . . 0.0 108.079 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.8 165.57 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.965 1.706 . . . . 0.0 109.216 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.2 t -61.56 -24.77 66.88 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.896 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -81.88 7.93 11.63 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.577 2.351 . . . . 0.0 110.042 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt 68.84 -0.8 2.24 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.32 2.248 . . . . 0.0 109.794 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.1 t -75.16 168.57 19.73 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.434 ' CB ' HD11 ' A' ' 93' ' ' ILE . 2.0 mm? -114.81 156.18 25.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.401 1.081 . . . . 0.0 111.853 -178.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.3 p -145.8 166.48 25.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.842 0.857 . . . . 0.0 110.384 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 52.9 ttm -132.52 140.15 48.2 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.889 1.676 . . . . 0.0 109.285 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.15 110.23 3.31 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 124.884 1.23 . . . . 0.0 112.838 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.8 mt -130.55 124.37 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 49.59 53.67 12.33 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.436 2.294 . . . . 0.0 109.233 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 59.95 11.8 2.79 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.861 2.065 . . . . 0.0 114.825 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -119.43 132.89 55.9 Favored 'General case' 0 CA--C 1.514 -0.405 0 O-C-N 120.95 -1.094 . . . . 0.0 109.715 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -86.17 115.82 23.98 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -108.44 132.2 54.02 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.179 0.992 . . . . 0.0 110.56 -178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.411 ' HB2' HD13 ' A' ' 33' ' ' ILE . 16.9 ttpt -65.26 151.17 46.85 Favored 'General case' 0 C--O 1.238 0.449 0 O-C-N 122.053 -0.405 . . . . 0.0 111.023 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.475 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -117.25 133.22 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.26 157.7 55.11 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 125.274 1.43 . . . . 0.0 109.208 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.27 153.78 56.43 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.031 3.154 . . . . 0.0 110.846 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.57 -17.93 57.08 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.111 0.564 . . . . 0.0 111.544 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.9 m -77.0 -20.73 55.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.057 -0.497 . . . . 0.0 111.993 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.77 -0.16 41.85 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.901 0.773 . . . . 0.0 110.737 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.442 ' HE2' ' CD1' ' A' ' 27' ' ' PHE . 61.7 mmtt -59.98 150.75 28.07 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 102.09 -31.9 8.16 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 109.136 -1.585 . . . . 0.0 109.136 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.2 -19.36 14.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.93 1.692 . . . . 0.0 110.167 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.79 154.16 10.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 127.407 2.283 . . . . 0.0 106.854 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -131.34 170.87 14.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.718 1.607 . . . . 0.0 108.622 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.43 165.2 14.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.9 168.4 13.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -113.25 140.23 48.14 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 125.159 1.384 . . . . 0.0 109.454 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.406 HD12 ' H ' ' A' ' 107' ' ' LEU . 2.6 mp -71.47 -13.2 61.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.108 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -56.93 -26.72 59.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.949 0.9 . . . . 0.0 111.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -64.38 -19.65 65.62 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.197 1.399 . . . . 0.0 112.821 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.375 1.87 . . . . 0.0 111.646 -177.012 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt . . . . . 0 N--CA 1.463 0.21 0 CA-C-O 121.512 0.672 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -90.55 118.7 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.462 ' HD2' HD13 ' A' ' 20' ' ' ILE . 10.8 ttm180 -84.59 100.65 11.56 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.42 138.94 40.68 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -64.95 -34.67 78.96 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 115.351 1.611 . . . . 0.0 115.351 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 57.86 139.86 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.899 2.079 . . . . 0.0 114.751 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.36 15.87 52.97 Favored Glycine 0 CA--C 1.534 1.273 0 O-C-N 121.156 -0.965 . . . . 0.0 111.965 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.11 177.33 7.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 127.644 2.378 . . . . 0.0 108.914 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -167.31 0.49 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 131.038 3.735 . . . . 0.0 109.24 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.285 24.2 p -78.76 119.07 21.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 123.771 1.748 . . . . 0.0 106.985 -176.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.13 139.75 2.87 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 130.974 3.71 . . . . 0.0 107.676 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -162.6 156.75 21.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 128.116 2.566 . . . . 0.0 107.08 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.462 HD13 ' HD2' ' A' ' 10' ' ' ARG . 2.2 mp -118.92 126.24 75.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 123.618 0.767 . . . . 0.0 108.971 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -131.5 138.66 49.06 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.291 1.036 . . . . 0.0 110.046 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.9 t70 54.05 34.16 19.24 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.343 1.857 . . . . 0.0 113.071 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 66.02 31.48 9.03 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 0.0 110.923 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -134.62 127.66 31.62 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 126.168 1.787 . . . . 0.0 106.641 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.6 m -76.16 132.11 39.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.95 172.59 9.27 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 127.951 2.5 . . . . 0.0 111.797 -177.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.316 25.9 p90 -153.19 144.79 23.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 129.486 3.114 . . . . 0.0 113.63 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' ILE . 47.3 t -82.52 133.84 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.6 p -103.57 167.88 9.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.694 1.198 . . . . 0.0 110.107 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -72.14 -12.0 61.0 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.895 1.678 . . . . 0.0 113.201 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 111.44 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.911 1.284 . . . . 0.0 113.238 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.409 ' C ' HD12 ' A' ' 33' ' ' ILE . 57.7 tt0 -89.92 146.71 24.2 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.424 1.49 . . . . 0.0 109.29 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.409 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.68 140.04 24.84 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.697 1.599 . . . . 0.0 107.929 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.81 150.35 61.69 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.817 . . . . 0.0 110.672 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -61.37 -19.42 61.84 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.51 -21.44 60.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.375 0.67 . . . . 0.0 110.588 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.69 -20.04 26.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.836 0.454 . . . . 0.0 111.554 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.0 t -61.3 130.45 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -89.87 -57.96 2.68 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.505 1.122 . . . . 0.0 110.5 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -164.05 172.33 13.96 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.079 0.952 . . . . 0.0 110.514 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.8 p -68.16 162.7 24.25 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -137.28 -45.07 0.56 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.33 122.81 2.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 118.598 0.635 . . . . 0.0 112.069 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -99.9 112.13 24.41 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -150.05 156.45 41.69 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 129.302 3.041 . . . . 0.0 104.893 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -131.8 119.36 21.15 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.46 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -148.12 135.12 20.21 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.46 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.1 tt -137.88 138.18 38.81 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 127.238 2.215 . . . . 0.0 109.147 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -144.42 169.65 17.53 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.991 0.916 . . . . 0.0 110.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.59 128.29 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.042 1.337 . . . . 0.0 107.957 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.67 134.68 65.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 124.799 1.24 . . . . 0.0 108.839 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -76.92 124.24 27.47 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 54.4 mtp -68.79 -29.76 68.18 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 120.255 -1.528 . . . . 0.0 112.887 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -79.48 -53.33 6.99 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.526 0.73 . . . . 0.0 110.784 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -81.48 -17.03 50.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.95 -1.024 . . . . 0.0 111.76 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 59.87 37.44 21.69 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.28 0.945 . . . . 0.0 109.664 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -129.42 161.38 30.5 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.411 1.084 . . . . 0.0 112.392 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.47 147.08 40.13 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.119 0.887 . . . . 0.0 110.061 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.8 mt -131.54 170.49 14.65 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.801 1.24 . . . . 0.0 112.112 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.83 -44.8 8.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.1 161.12 22.3 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.217 1.007 . . . . 0.0 112.665 -177.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.8 p -80.71 96.59 6.96 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -77.23 168.21 20.44 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 105.585 -2.006 . . . . 0.0 105.585 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -69.95 -23.32 63.17 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -80.93 2.95 24.52 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 m -119.28 161.0 21.15 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.653 1.181 . . . . 0.0 112.581 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 55.9 t -136.66 154.95 32.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 126.501 1.92 . . . . 0.0 106.144 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.65 143.47 37.67 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.525 HD21 HD23 ' A' ' 107' ' ' LEU . 2.0 mm? -125.54 145.52 50.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -116.46 103.06 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -101.81 94.54 5.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.97 -173.35 2.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.176 -177.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 51.35 68.09 0.85 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.058 0.943 . . . . 0.0 113.241 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mt -74.68 143.86 12.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 124.903 1.281 . . . . 0.0 109.155 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -136.64 170.22 16.42 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.381 2.272 . . . . 0.0 109.868 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -116.97 157.77 25.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 126.316 1.846 . . . . 0.0 107.699 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.29 165.47 15.43 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.38 1.472 . . . . 0.0 111.463 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.5 t -56.08 -36.32 67.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.587 1.555 . . . . 0.0 111.326 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -87.99 17.93 4.59 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.667 0.787 . . . . 0.0 110.969 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt 67.61 3.25 3.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.372 1.869 . . . . 0.0 111.914 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.0 m -68.63 154.87 41.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.2 mt -114.63 147.58 39.35 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.4 p -142.52 169.08 18.25 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.734 0.414 . . . . 0.0 110.987 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 tpp -128.79 140.15 51.85 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.085 2.154 . . . . 0.0 108.464 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -88.27 115.63 4.43 Favored Glycine 0 N--CA 1.462 0.391 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.492 HG22 HD22 ' A' ' 87' ' ' ASN . 45.5 mt -132.09 119.98 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.492 HD22 HG22 ' A' ' 86' ' ' ILE . 9.7 m-80 50.5 47.09 24.65 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 122.1 0.953 . . . . 0.0 111.139 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 62.7 9.94 3.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 128.69 2.796 . . . . 0.0 113.672 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -112.08 125.3 53.95 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.613 1.565 . . . . 0.0 107.989 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -86.14 116.03 24.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.43 132.11 54.1 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.573 1.149 . . . . 0.0 109.402 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -63.61 155.46 29.62 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.465 0.706 . . . . 0.0 112.632 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -124.62 132.69 70.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 178.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.29 160.05 59.57 Favored Pre-proline 0 N--CA 1.474 0.767 0 C-N-CA 126.026 1.73 . . . . 0.0 110.248 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.52 152.32 78.62 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 109.835 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -60.64 -14.82 22.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.56 -0.257 . . . . 0.0 111.666 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.92 -13.64 62.55 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.283 -0.886 . . . . 0.0 110.953 177.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -2.75 40.53 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.829 1.195 . . . . 0.0 111.277 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp -52.47 152.16 3.72 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 120.846 -1.159 . . . . 0.0 110.954 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.68 -42.34 3.04 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -95.65 -14.0 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.211 1.506 . . . . 0.0 110.9 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 20.0 t -143.13 155.06 16.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 C-N-CA 126.818 2.047 . . . . 0.0 106.996 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -133.75 162.38 32.12 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.208 1.003 . . . . 0.0 109.08 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.33 159.7 26.19 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 165.09 13.56 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -125.27 140.34 52.92 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.711 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.0 OUTLIER -65.04 -12.85 55.13 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 126.369 1.868 . . . . 0.0 112.692 179.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.31 -16.68 48.31 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.417 1.008 . . . . 0.0 112.15 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -81.49 -5.02 57.53 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 110.981 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.873 2.069 . . . . 0.0 107.045 -179.705 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.37 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.2 t -124.45 144.16 35.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 124.414 1.086 . . . . 0.0 110.26 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -112.56 138.13 49.8 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -113.41 152.17 30.4 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.69 -25.84 68.12 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.659 0.784 . . . . 0.0 111.622 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.8 137.99 0.03 OUTLIER 'General case' 0 C--O 1.236 0.383 0 C-N-CA 129.327 3.051 . . . . 0.0 112.022 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.95 38.04 30.38 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.881 1.229 . . . . 0.0 111.545 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -139.82 179.04 6.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.347 1.859 . . . . 0.0 112.307 -176.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -74.67 -169.19 0.82 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.532 2.733 . . . . 0.0 107.91 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.254 22.8 p -80.16 120.46 24.32 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 119.385 -2.072 . . . . 0.0 109.363 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -168.83 143.41 3.18 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 129.604 3.161 . . . . 0.0 106.548 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 41.3 p90 -164.44 173.17 12.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 119.285 0.948 . . . . 0.0 109.139 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -130.67 123.27 54.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 O-C-N 121.538 -0.726 . . . . 0.0 109.512 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -137.26 145.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 104.632 -2.358 . . . . 0.0 104.632 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.1 t0 53.47 35.33 20.38 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 122.419 1.104 . . . . 0.0 111.399 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 57.59 22.83 8.61 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.347 1.859 . . . . 0.0 113.126 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -123.41 150.77 43.36 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.618 1.567 . . . . 0.0 109.305 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.8 m -79.29 123.05 27.08 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 8.4 m-85 -127.5 161.35 28.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.423 1.489 . . . . 0.0 109.087 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' CE2' HG22 ' A' ' 29' ' ' THR . 31.3 p90 -149.17 167.38 26.12 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.004 -1.06 . . . . 0.0 108.408 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -97.45 127.58 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 ' CE2' ' A' ' 27' ' ' PHE . 30.3 p -94.99 167.49 11.36 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.752 1.221 . . . . 0.0 111.689 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -75.15 -13.0 60.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.978 1.711 . . . . 0.0 111.988 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' HG13 ' A' ' 102' ' ' VAL . 1.7 mptp? -69.59 102.77 1.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.645 1.578 . . . . 0.0 109.6 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -89.93 145.64 24.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.47 139.93 22.55 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.599 1.959 . . . . 0.0 108.823 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.59 148.61 20.59 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.26 2.64 . . . . 0.0 109.893 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -55.27 -31.97 61.99 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.26 -19.39 64.51 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.58 0.752 . . . . 0.0 112.629 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -101.84 -9.76 20.48 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.523 0.729 . . . . 0.0 111.064 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.6 t -74.87 124.2 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -73.66 -59.57 2.65 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.375 1.07 . . . . 0.0 110.799 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.19 169.07 6.58 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 126.172 1.789 . . . . 0.0 109.63 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 57.5 p -62.48 169.61 2.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.301 1.84 . . . . 0.0 112.913 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -140.51 -47.71 0.43 Allowed 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 116.746 -1.597 . . . . 0.0 114.364 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 t -153.06 130.02 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 121.248 1.84 . . . . 0.0 111.416 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -99.29 106.13 18.22 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.296 1.038 . . . . 0.0 111.042 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -128.87 158.04 39.87 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 129.65 3.18 . . . . 0.0 106.166 178.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.03 109.83 6.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.487 1.04 . . . . 0.0 109.761 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.36 139.0 22.85 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.985 0.811 . . . . 0.0 109.898 178.037 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.506 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.2 tt -133.53 141.76 47.89 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.465 1.506 . . . . 0.0 108.53 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.584 HD11 HD21 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -148.92 171.16 16.78 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.183 1.393 . . . . 0.0 110.74 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.4 mt -127.3 142.57 43.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.76 1.224 . . . . 0.0 110.725 -178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -137.48 128.83 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.711 1.204 . . . . 0.0 111.712 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.48 ' HB2' HD21 ' A' ' 59' ' ' LEU . 9.4 t0 -73.62 111.48 8.8 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.801 1.64 . . . . 0.0 108.041 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 63.0 mtp -56.99 -25.22 57.96 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.355 1.434 . . . . 0.0 113.494 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? -60.09 -53.52 56.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.947 0.499 . . . . 0.0 111.05 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.5 m -106.12 -6.54 18.53 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 59.57 30.84 20.51 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.803 2.041 . . . . 0.0 109.878 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.94 154.01 24.71 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 124.923 1.289 . . . . 0.0 112.34 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.11 150.1 49.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.22 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.48 HD21 ' HB2' ' A' ' 52' ' ' ASP . 54.3 mt -127.45 174.31 9.11 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 124.417 1.087 . . . . 0.0 110.781 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -108.96 0.45 20.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.802 2.041 . . . . 0.0 113.028 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.1 p -163.01 162.98 26.22 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.543 1.137 . . . . 0.0 108.413 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.7 m -91.72 117.43 29.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.486 1.914 . . . . 0.0 112.818 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -124.35 157.22 35.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.97 1.708 . . . . 0.0 109.317 177.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -56.28 -18.03 9.39 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -96.66 4.18 52.04 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.364 0.666 . . . . 0.0 111.072 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.5 t -120.32 169.53 10.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.995 2.118 . . . . 0.0 107.92 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 92.5 t -143.47 145.38 22.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 t -95.46 142.18 28.13 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 106.479 -1.675 . . . . 0.0 106.479 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.2 mt -123.6 151.73 42.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.7 t -128.49 104.33 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 105.332 -2.099 . . . . 0.0 105.332 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 49' ' ' LEU . 2.1 mm? -97.94 95.12 7.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.601 1.092 . . . . 0.0 109.837 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.49 -167.75 0.93 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 56.0 67.9 0.94 Allowed 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.418 1.087 . . . . 0.0 113.701 175.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.3 mt -77.87 139.99 17.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 121.195 -0.941 . . . . 0.0 109.038 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.82 168.41 19.88 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.834 2.054 . . . . 0.0 109.229 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -115.23 151.22 34.87 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 126.363 1.865 . . . . 0.0 107.204 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.12 159.99 16.43 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.527 1.531 . . . . 0.0 109.837 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -59.54 -33.24 71.15 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.986 0.914 . . . . 0.0 110.779 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -83.05 17.0 2.1 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.877 1.271 . . . . 0.0 110.405 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp 68.65 2.09 3.29 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.84 2.056 . . . . 0.0 111.142 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 44.3 m -70.01 160.98 30.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.95 146.09 41.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.542 1.137 . . . . 0.0 108.145 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.2 p -142.48 167.14 22.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.542 -0.724 . . . . 0.0 110.609 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 36.0 ttm -134.13 137.47 44.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.552 1.941 . . . . 0.0 109.029 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.6 123.38 6.03 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 127.336 2.398 . . . . 0.0 111.087 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.7 mt -138.98 117.32 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 50.67 43.69 27.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.901 0.881 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 73.94 -1.28 3.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.123 2.569 . . . . 0.0 115.357 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -105.45 134.76 48.04 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.968 1.307 . . . . 0.0 108.6 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -89.89 117.09 28.45 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.12 0.568 . . . . 0.0 109.819 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -109.02 130.24 55.47 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.289 1.436 . . . . 0.0 110.742 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -62.89 147.76 49.29 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.308 0.643 . . . . 0.0 110.387 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -115.95 133.46 62.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.21 161.05 56.56 Favored Pre-proline 0 C--O 1.236 0.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.952 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -74.95 144.29 30.26 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 122.696 2.264 . . . . 0.0 109.05 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -58.11 -18.18 23.31 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.78 -11.1 59.99 Favored 'General case' 0 N--CA 1.445 -0.71 0 O-C-N 121.006 -1.059 . . . . 0.0 112.571 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.5 1.66 28.5 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.34 1.427 . . . . 0.0 112.426 178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -46.11 144.42 1.94 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 126.606 1.962 . . . . 0.0 112.279 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.43 -43.11 1.94 Allowed Glycine 0 CA--C 1.518 0.251 0 C-N-CA 127.172 2.32 . . . . 0.0 110.662 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.06 -18.17 22.1 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 117.936 0.868 . . . . 0.0 110.457 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.4 HG13 ' HE2' ' A' ' 31' ' ' LYS . 2.0 t -138.62 158.1 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 125.832 1.653 . . . . 0.0 107.713 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -141.98 168.63 19.28 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 127.938 2.495 . . . . 0.0 106.629 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.63 -179.66 1.46 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.744 0.783 . . . . 0.0 111.038 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.95 173.25 10.23 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -123.39 141.86 51.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.719 1.208 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.429 HD12 ' H ' ' A' ' 107' ' ' LEU . 1.1 mp -69.97 -8.84 52.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.403 0.681 . . . . 0.0 111.787 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.24 -22.37 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.964 1.706 . . . . 0.0 110.942 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.97 -5.57 49.16 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.833 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 124.843 1.257 . . . . 0.0 111.556 -177.979 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 14.6 ttmm . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.417 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 24.1 t -126.71 126.12 68.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -91.67 135.72 33.67 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -106.18 165.35 11.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.49 -33.54 48.11 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 53.19 98.08 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.996 1.718 . . . . 0.0 113.386 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 9.25 37.46 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 125.466 1.508 . . . . 0.0 112.955 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.9 m -131.6 178.68 6.55 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 127.39 2.276 . . . . 0.0 109.469 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.4 -167.9 0.48 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 130.733 3.613 . . . . 0.0 107.833 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.4 p -78.87 121.13 24.44 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 124.317 2.008 . . . . 0.0 109.642 -176.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -167.0 143.84 4.58 Favored 'General case' 0 N--CA 1.448 -0.558 1 C-N-CA 132.299 4.24 . . . . 0.0 104.6 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.426 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 29.4 p90 -165.2 171.26 13.9 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 125.044 1.338 . . . . 0.0 107.447 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -132.72 123.53 49.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 O-C-N 121.558 -0.714 . . . . 0.0 109.533 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -128.07 136.64 51.49 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 125.515 1.526 . . . . 0.0 107.019 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.4 t70 52.45 34.95 16.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.272 1.429 . . . . 0.0 110.355 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 64.64 12.73 7.78 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.795 2.038 . . . . 0.0 112.593 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -106.38 138.08 43.2 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 126.216 1.807 . . . . 0.0 108.299 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -68.72 136.64 53.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.3 m-85 -144.9 159.27 43.17 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.976 0.911 . . . . 0.0 109.275 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -149.36 164.26 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.394 -0.816 . . . . 0.0 109.174 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 t -97.63 132.31 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.27 175.57 5.43 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.379 0.609 . . . . 0.0 109.729 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -77.06 -11.09 59.76 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.38 1.072 . . . . 0.0 113.208 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.19 110.97 5.48 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.211 1.004 . . . . 0.0 108.871 178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -98.88 143.42 29.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.439 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -118.75 136.19 24.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.67 159.44 52.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.931 2.421 . . . . 0.0 112.905 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -61.83 -27.75 68.99 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -71.77 -22.67 61.56 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.946 0.794 . . . . 0.0 110.093 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -84.47 -24.7 29.35 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -64.81 147.07 12.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -112.08 -60.97 1.78 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.602 1.161 . . . . 0.0 110.937 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -153.93 168.01 27.82 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.391 0.676 . . . . 0.0 112.486 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 p -69.87 147.57 50.13 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 126.12 1.768 . . . . 0.0 109.196 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -119.25 -52.6 2.28 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 117.791 -1.1 . . . . 0.0 111.404 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 t -149.11 118.59 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 119.787 1.176 . . . . 0.0 112.598 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -86.03 101.45 12.94 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 177.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.49 158.23 34.99 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 128.834 2.854 . . . . 0.0 107.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -141.12 108.16 5.45 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 120.21 1.368 . . . . 0.0 111.984 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.757 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -148.13 138.58 22.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.325 -0.859 . . . . 0.0 110.432 178.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -130.76 145.08 51.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 127.467 2.307 . . . . 0.0 108.15 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.757 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -150.24 171.34 17.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.394 1.877 . . . . 0.0 109.03 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.0 mt -128.22 131.93 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 124.433 1.093 . . . . 0.0 108.104 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.59 130.21 74.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.296 1.038 . . . . 0.0 111.01 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.63 122.61 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 127.244 2.217 . . . . 0.0 110.109 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.0 mmm -69.25 -21.8 63.88 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -83.07 -53.26 5.94 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.495 1.118 . . . . 0.0 110.991 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.3 m -92.4 -11.01 36.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.105 -178.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 60.89 23.43 13.48 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 120.073 1.306 . . . . 0.0 110.766 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 mtpp -110.98 162.7 14.58 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.944 1.298 . . . . 0.0 111.371 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.621 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -74.98 146.57 41.57 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.29 0.636 . . . . 0.0 110.88 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.5 mt -135.22 174.98 10.01 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.87 1.668 . . . . 0.0 109.761 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.9 m -115.09 -8.65 12.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.607 1.163 . . . . 0.0 110.455 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.6 m -116.92 127.11 53.92 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.569 1.148 . . . . 0.0 113.086 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.1 t -80.13 99.23 7.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -121.41 166.84 13.52 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.369 0.668 . . . . 0.0 109.984 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -56.5 -36.78 69.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -87.73 18.53 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.065 0.546 . . . . 0.0 110.401 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.8 t -138.37 154.46 48.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 126.173 1.789 . . . . 0.0 108.678 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.64 139.87 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.052 0.941 . . . . 0.0 109.194 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.71 144.37 26.04 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.938 0.895 . . . . 0.0 109.543 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -136.15 150.47 49.07 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.013 1.325 . . . . 0.0 107.519 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 t -125.37 103.35 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.29 95.26 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.59 -174.82 4.65 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.81 68.95 0.48 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.73 2.012 . . . . 0.0 114.616 178.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.6 mt -68.9 145.36 13.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.679 1.192 . . . . 0.0 110.107 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -140.12 169.69 17.22 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 128.134 2.574 . . . . 0.0 110.414 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -115.78 163.68 15.48 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 127.781 2.432 . . . . 0.0 108.672 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -120.86 168.64 11.25 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.799 2.04 . . . . 0.0 109.994 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -57.3 -36.93 71.69 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.97 18.78 2.84 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.874 1.27 . . . . 0.0 111.403 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt 66.14 9.86 6.61 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.065 1.346 . . . . 0.0 112.261 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 t -73.92 137.92 43.95 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -100.18 150.46 22.49 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 122.974 0.51 . . . . 0.0 109.808 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.1 p -145.68 171.11 15.2 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.802 0.441 . . . . 0.0 112.117 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.9 ttm -137.18 142.17 42.17 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.1 1.76 . . . . 0.0 110.644 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.81 129.55 9.14 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 124.772 1.177 . . . . 0.0 110.824 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.9 mt -147.6 126.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 50.69 39.99 23.03 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.765 0.826 . . . . 0.0 110.396 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 63.54 15.55 8.93 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.975 2.11 . . . . 0.0 114.755 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -118.22 140.34 49.95 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 125.495 1.518 . . . . 0.0 107.388 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -91.33 116.15 28.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.903 -0.498 . . . . 0.0 110.81 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.28 127.25 53.38 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.975 1.31 . . . . 0.0 109.769 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.572 ' HE3' HD21 ' A' ' 94' ' ' LEU . 15.9 tttp -60.98 154.65 21.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.184 0.993 . . . . 0.0 110.216 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -120.24 132.66 69.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.572 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.1 mm? -120.42 155.47 56.36 Favored Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 124.486 1.114 . . . . 0.0 110.286 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.35 147.87 60.04 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.706 2.271 . . . . 0.0 107.864 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.11 -18.43 47.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.136 0.426 . . . . 0.0 111.919 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.6 t -67.51 -21.61 65.48 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 121.301 -0.875 . . . . 0.0 109.964 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -79.66 -3.11 45.79 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.119 0.968 . . . . 0.0 113.392 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -52.62 155.87 2.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.313 1.054 . . . . 0.0 109.571 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.85 -42.51 2.65 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.24 -32.47 24.44 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 p -137.7 162.37 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 C-N-CA 125.957 1.703 . . . . 0.0 108.955 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -136.31 170.61 15.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.922 2.489 . . . . 0.0 107.529 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.11 166.24 2.95 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.797 0.808 . . . . 0.0 110.699 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.614 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -65.15 171.9 3.39 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.177 0.591 . . . . 0.0 111.558 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.614 ' N ' HD12 ' A' ' 105' ' ' LEU . 61.9 mtm180 -127.29 136.29 51.76 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.722 0.809 . . . . 0.0 111.162 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.8 OUTLIER -67.32 -21.32 65.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 124.342 1.057 . . . . 0.0 112.2 -179.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -60.05 -10.85 4.72 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -81.9 -0.43 43.73 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.867 0.758 . . . . 0.0 109.81 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.245 0.839 0 C-N-CA 127.579 2.352 . . . . 0.0 107.914 -179.454 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.286 0 CA-C-O 120.598 0.237 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.8 t -132.96 130.62 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.7 ttm-85 -102.6 115.83 31.36 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -86.81 166.77 14.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -75.19 -33.04 61.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.933 0.788 . . . . 0.0 112.104 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 60.41 117.73 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.297 1.839 . . . . 0.0 114.295 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.63 18.96 78.54 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -137.94 178.04 7.42 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.938 1.695 . . . . 0.0 111.184 -178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -74.18 -168.38 0.63 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 128.707 2.803 . . . . 0.0 108.937 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.4 p -79.12 120.16 23.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.436 2.065 . . . . 0.0 107.849 -176.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -168.64 145.76 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 130.353 3.461 . . . . 0.0 105.941 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 39.4 p90 -165.21 174.91 9.75 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.215 2.206 . . . . 0.0 106.771 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 73.2 mt -135.44 128.28 47.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -137.09 140.63 42.09 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.2 t70 51.83 39.19 25.16 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.9 1.68 . . . . 0.0 112.489 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.61 16.78 10.66 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.629 1.572 . . . . 0.0 112.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -120.2 141.87 49.52 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.872 1.269 . . . . 0.0 110.08 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.9 m -72.33 127.42 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.691 1.597 . . . . 0.0 108.706 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -140.39 160.03 40.89 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.565 0.746 . . . . 0.0 112.34 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -148.8 162.57 39.53 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 121.21 -0.931 . . . . 0.0 111.189 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.2 t -92.23 127.55 44.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 124.097 0.959 . . . . 0.0 109.894 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.8 p -98.97 171.13 8.24 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.817 1.247 . . . . 0.0 109.863 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -81.17 -10.9 59.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.998 1.719 . . . . 0.0 112.598 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.29 111.5 5.94 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.552 1.941 . . . . 0.0 109.692 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.8 tt0 -95.96 146.36 24.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.309 1.444 . . . . 0.0 111.864 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.99 131.77 24.01 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.748 2.419 . . . . 0.0 107.253 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.95 156.28 47.82 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.591 2.86 . . . . 0.0 112.484 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -58.26 -26.6 63.12 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.085 0.954 . . . . 0.0 113.5 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.41 -26.21 63.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.317 0.508 . . . . 0.0 110.665 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -82.82 -25.33 32.79 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.56 118.2 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.014 0.925 . . . . 0.0 108.598 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -77.77 -61.04 2.12 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.049 0.94 . . . . 0.0 109.776 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -159.75 173.63 15.73 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.86 0.864 . . . . 0.0 109.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.423 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 70.0 m -62.91 171.36 2.2 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.024 1.33 . . . . 0.0 110.933 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -145.79 -45.03 0.21 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 120.559 -1.338 . . . . 0.0 113.746 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.2 t -152.44 132.88 4.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-N 118.983 0.811 . . . . 0.0 109.693 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -109.52 109.01 19.69 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.094 1.358 . . . . 0.0 107.782 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -139.39 157.41 45.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 127.894 2.478 . . . . 0.0 107.274 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -125.27 107.48 10.76 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.469 ' HE2' HD23 ' A' ' 49' ' ' LEU . 12.8 tptm -145.59 122.72 11.46 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.835 0.743 . . . . 0.0 109.332 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.4 tt -129.73 143.36 50.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 128.548 2.739 . . . . 0.0 106.575 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.469 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -152.23 170.54 19.77 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 126.047 1.739 . . . . 0.0 107.245 178.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.434 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.5 mt -129.22 132.02 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.1 t -121.98 136.16 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.047 1.339 . . . . 0.0 108.755 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -78.85 119.04 21.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 126.001 1.72 . . . . 0.0 109.301 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.9 mtp -68.44 -19.53 64.58 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 121.789 2.086 . . . . 0.0 111.531 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -38.27 69.08 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 117.914 -1.041 . . . . 0.0 113.638 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.3 p -121.98 -9.06 8.79 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 60.31 41.19 16.74 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 125.969 1.707 . . . . 0.0 111.024 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -122.47 158.26 30.15 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.902 1.281 . . . . 0.0 109.491 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.434 HD13 ' O ' ' A' ' 50' ' ' ILE . 4.3 mm? -71.02 146.95 49.07 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.02 0.528 . . . . 0.0 111.734 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.6 mt -132.64 158.17 42.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.704 1.602 . . . . 0.0 110.3 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -86.75 -21.84 26.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.524 0.73 . . . . 0.0 110.726 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -135.95 146.79 47.65 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.462 1.505 . . . . 0.0 111.246 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.64 98.85 11.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 127.595 2.358 . . . . 0.0 112.03 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -97.08 171.76 8.27 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.8 -0.563 . . . . 0.0 110.155 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -53.61 -21.89 7.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.697 2.399 . . . . 0.0 117.462 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -105.73 1.17 26.86 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.578 1.951 . . . . 0.0 110.675 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.7 t -114.69 161.83 17.62 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.974 1.71 . . . . 0.0 110.63 -177.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.2 t -138.55 126.46 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 124.612 1.165 . . . . 0.0 109.284 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.9 t -77.31 143.09 39.07 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.9 mt -130.21 145.41 51.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.38 103.69 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.26 93.03 6.66 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.31 -162.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 44.17 67.28 0.7 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.699 1.999 . . . . 0.0 111.482 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 mt -75.14 142.64 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.427 1.091 . . . . 0.0 110.105 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 73.6 m-85 -141.87 158.6 43.59 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -103.03 165.5 10.99 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.718 1.207 . . . . 0.0 110.104 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.24 169.99 12.31 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.733 0.813 . . . . 0.0 112.736 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -58.78 -41.1 85.88 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.245 1.418 . . . . 0.0 109.814 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.03 13.24 5.22 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.579 1.951 . . . . 0.0 109.797 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.46 10.98 5.23 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.85 2.06 . . . . 0.0 110.922 -177.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.2 m -65.41 149.58 49.76 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -111.32 140.23 46.06 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.13 175.2 9.82 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.818 0.847 . . . . 0.0 112.086 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.8 ttm -134.83 142.14 46.57 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.9 2.08 . . . . 0.0 108.967 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.65 125.78 8.09 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.953 -1.659 . . . . 0.0 108.953 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.2 mt -142.6 121.53 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 48.35 54.94 9.59 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.254 1.421 . . . . 0.0 113.51 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 69.25 -2.84 1.71 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.88 1.672 . . . . 0.0 114.712 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -112.78 156.7 22.41 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 125.129 1.372 . . . . 0.0 109.469 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.69 117.0 29.6 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.14 0.976 . . . . 0.0 109.396 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.76 133.64 52.91 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.269 1.428 . . . . 0.0 112.175 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HE3' HD21 ' A' ' 94' ' ' LEU . 13.2 ttpt -63.1 145.07 56.25 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.757 0.823 . . . . 0.0 110.877 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -110.36 132.63 58.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.482 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.4 mm? -126.46 156.32 73.07 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.19 161.8 42.18 Favored 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 122.247 1.965 . . . . 0.0 111.057 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -21.25 66.46 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.56 -6.04 37.77 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.024 1.33 . . . . 0.0 112.579 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.33 -3.94 36.05 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.374 0.988 . . . . 0.0 111.69 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 20.1 mmtm -54.47 156.96 3.06 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-N 119.596 1.089 . . . . 0.0 111.873 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 108.49 -42.81 1.85 Allowed Glycine 0 CA--C 1.521 0.464 0 N-CA-C 108.396 -1.882 . . . . 0.0 108.396 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.37 -42.25 8.99 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.1 159.96 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 125.617 1.567 . . . . 0.0 110.77 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -143.07 173.29 11.7 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.694 2.798 . . . . 0.0 107.0 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.6 164.88 4.18 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.655 1.182 . . . . 0.0 110.359 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 172.96 3.89 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -116.97 127.39 54.15 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 125.385 1.474 . . . . 0.0 108.655 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.5 OUTLIER -64.93 -20.17 66.32 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.578 0.751 . . . . 0.0 111.121 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -55.04 -24.86 26.91 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.54 1.536 . . . . 0.0 111.782 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -68.86 -16.0 63.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.495 -0.753 . . . . 0.0 110.416 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 125.999 1.72 . . . . 0.0 109.789 -178.98 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt . . . . . 0 C--O 1.232 0.18 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.43 135.89 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.1 ttt-85 -107.91 98.52 8.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -82.24 148.92 28.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.55 -33.73 73.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 117.885 -1.055 . . . . 0.0 112.686 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 79.06 131.07 0.05 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 129.7 3.2 . . . . 0.0 114.281 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.41 34.49 54.64 Favored Glycine 0 CA--C 1.522 0.501 0 C-N-CA 126.088 1.804 . . . . 0.0 111.196 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.9 p -137.83 178.48 7.08 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 110.575 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.78 -170.08 0.65 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.891 2.076 . . . . 0.0 109.328 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.3 p -79.6 120.22 23.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 123.927 1.822 . . . . 0.0 108.535 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -167.44 149.95 5.98 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 130.976 3.71 . . . . 0.0 105.014 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 42.7 p90 -172.88 175.86 3.22 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.4 mt -134.56 130.94 53.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -130.61 138.15 49.97 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.6 t0 47.57 42.97 15.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.747 1.619 . . . . 0.0 113.832 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 61.0 22.51 12.75 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 0.0 112.877 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -122.9 128.64 50.6 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.222 1.809 . . . . 0.0 106.623 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 71.2 m -74.75 132.25 41.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -130.35 166.28 20.75 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 127.013 2.125 . . . . 0.0 110.348 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -148.54 166.35 28.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -99.63 126.93 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.2 p -93.26 171.18 9.08 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.896 0.878 . . . . 0.0 110.291 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -77.86 -15.67 58.87 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.463 1.505 . . . . 0.0 111.53 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.8 122.77 18.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.991 1.317 . . . . 0.0 110.618 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 32.6 tt0 -111.0 145.68 38.02 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.227 1.411 . . . . 0.0 110.394 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -115.64 141.23 27.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.651 1.18 . . . . 0.0 108.654 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.99 152.15 51.19 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.208 2.605 . . . . 0.0 110.352 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.55 -33.04 63.5 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.49 ' HG3' HD22 ' A' ' 37' ' ' ASN . 9.4 pt-20 -64.56 -20.8 66.46 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.49 HD22 ' HG3' ' A' ' 36' ' ' GLU . 2.3 m-80 -90.97 -15.38 29.81 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.566 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.2 t -70.9 123.75 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.906 0.882 . . . . 0.0 108.623 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -62.04 1.72 Allowed 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.87 173.01 14.27 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.135 0.88 . . . . 0.0 110.825 178.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.5 p -65.34 135.78 55.72 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 125.49 1.516 . . . . 0.0 110.206 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.98 -49.39 3.14 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 116.996 -1.478 . . . . 0.0 112.656 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.8 t -143.92 122.01 6.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 120.185 1.357 . . . . 0.0 112.052 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -83.05 114.31 21.2 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.11 158.84 44.58 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 127.828 2.451 . . . . 0.0 109.623 -178.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -143.44 119.75 10.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.011 0.924 . . . . 0.0 109.434 178.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' HE3' HD23 ' A' ' 49' ' ' LEU . 3.0 tmtm? -148.08 136.61 21.57 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -133.59 144.71 49.46 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.338 1.855 . . . . 0.0 109.072 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.438 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -156.3 169.67 24.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.016 1.327 . . . . 0.0 109.551 177.732 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.9 mt -126.43 136.0 62.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 125.492 1.517 . . . . 0.0 107.898 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.2 t -134.82 134.25 53.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 125.911 1.684 . . . . 0.0 109.991 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -72.13 116.81 12.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 127.917 2.487 . . . . 0.0 111.699 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.7 mtp -68.24 -18.28 64.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.128 0.876 . . . . 0.0 112.176 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -66.43 -53.78 31.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.818 1.19 . . . . 0.0 111.372 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.7 m -122.6 8.61 9.53 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 59.44 47.09 11.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.227 1.811 . . . . 0.0 112.939 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -116.64 147.17 42.17 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.368 1.067 . . . . 0.0 108.883 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mp -69.52 155.8 39.9 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.644 ' CD1' HD21 ' A' ' 63' ' ' ASN . 86.8 mt -135.36 157.81 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.723 1.209 . . . . 0.0 110.465 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.9 p -88.1 -12.44 44.13 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.285 -1.34 . . . . 0.0 114.194 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 p -147.66 148.99 31.64 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 121.136 1.789 . . . . 0.0 112.31 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -69.77 116.97 10.77 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.862 1.265 . . . . 0.0 109.393 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.644 HD21 ' CD1' ' A' ' 59' ' ' LEU . 4.4 p30 -137.43 156.64 47.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.18 1.392 . . . . 0.0 109.806 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -54.44 -31.64 55.84 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -80.39 3.57 20.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.322 0.965 . . . . 0.0 111.311 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -124.47 177.01 6.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.934 1.694 . . . . 0.0 111.616 -177.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.0 t -142.46 150.28 18.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 127.959 2.503 . . . . 0.0 105.831 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.8 t -102.61 140.63 36.63 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.32 144.84 50.3 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 t -115.9 103.32 15.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.87 94.37 8.9 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.361 -1.462 . . . . 0.0 107.39 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.25 -173.76 3.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -177.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 46.45 69.46 0.48 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.335 1.854 . . . . 0.0 114.815 177.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.3 mt -70.01 143.87 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.53 169.39 17.87 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.775 2.03 . . . . 0.0 108.833 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -117.96 154.13 32.46 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.28 161.07 16.4 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.526 1.13 . . . . 0.0 110.009 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -65.78 -13.36 59.27 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.274 0.63 . . . . 0.0 111.421 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 2.89 56.41 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.224 1.41 . . . . 0.0 109.472 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm 79.6 -1.59 2.16 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 129.157 2.983 . . . . 0.0 112.11 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.5 m -77.35 162.38 27.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 120.55 1.523 . . . . 0.0 108.099 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.17 158.43 17.44 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.224 1.01 . . . . 0.0 109.639 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.3 p -149.32 172.79 14.32 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.037 0.835 . . . . 0.0 109.522 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.3 ttm -136.03 135.85 39.77 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.789 1.636 . . . . 0.0 108.449 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.26 109.88 3.12 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 74.9 mt -123.03 123.81 68.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.9 m120 51.7 37.91 21.41 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.794 1.237 . . . . 0.0 109.609 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 69.24 16.31 8.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.89 2.876 . . . . 0.0 114.554 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -117.17 132.75 56.58 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -86.5 115.92 24.3 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.569 -0.707 . . . . 0.0 110.252 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 76.4 m-85 -110.21 128.27 55.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.861 1.265 . . . . 0.0 111.295 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.94 144.63 52.76 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.037 0.935 . . . . 0.0 110.315 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.57 132.91 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.36 156.48 57.78 Favored Pre-proline 0 N--CA 1.467 0.384 0 C-N-CA 124.457 1.103 . . . . 0.0 108.658 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -75.12 156.41 42.47 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.23 1.953 . . . . 0.0 108.505 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -65.5 -11.18 41.03 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.464 -0.773 . . . . 0.0 110.958 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -21.93 63.81 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.166 -0.959 . . . . 0.0 109.503 177.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.9 -7.39 59.6 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.483 1.113 . . . . 0.0 111.823 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -56.07 149.33 15.84 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 107.87 -32.05 7.43 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -178.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.97 -8.97 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.416 1.486 . . . . 0.0 111.887 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -150.54 150.2 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 C-N-CA 126.404 1.882 . . . . 0.0 107.13 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -131.06 169.67 15.55 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.765 1.626 . . . . 0.0 107.994 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.65 163.4 11.44 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.126 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.35 167.65 10.16 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt85 -110.36 135.67 50.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 126.148 1.779 . . . . 0.0 110.753 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -68.77 -15.58 63.55 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -59.03 -23.02 61.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.186 1.794 . . . . 0.0 111.441 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.5 m-20 -73.57 -6.02 43.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 118.341 -0.837 . . . . 0.0 111.981 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.565 1.546 . . . . 0.0 111.755 -177.822 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 121.217 0.532 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.3 t -110.12 130.55 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -89.15 116.97 27.8 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -85.08 153.3 22.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -59.66 -34.34 72.71 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 128.109 2.564 . . . . 0.0 113.96 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 59.66 103.64 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 127.944 2.498 . . . . 0.0 113.704 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.409 ' HA2' ' CD2' ' A' ' 58' ' ' LEU . . . 69.93 31.84 69.84 Favored Glycine 0 CA--C 1.528 0.88 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.279 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -134.71 179.88 6.02 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.397 1.879 . . . . 0.0 112.659 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.53 -168.59 0.45 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.155 2.582 . . . . 0.0 107.502 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -78.46 120.37 23.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 116.993 -1.883 . . . . 0.0 108.295 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -168.06 146.68 4.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 128.949 2.899 . . . . 0.0 107.808 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -170.87 177.05 3.92 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.321 0.964 . . . . 0.0 109.429 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 44.1 mt -135.65 126.28 43.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 121.446 -0.784 . . . . 0.0 109.031 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -129.86 134.24 47.4 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 105.576 -2.009 . . . . 0.0 105.576 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.8 t0 53.15 38.09 26.64 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.255 1.022 . . . . 0.0 112.49 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 m120 62.57 16.02 8.43 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.482 2.313 . . . . 0.0 113.112 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -111.4 136.95 49.82 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.46 1.104 . . . . 0.0 108.796 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -71.55 122.24 20.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.449 1.5 . . . . 0.0 107.611 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -134.48 162.33 32.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.181 1.393 . . . . 0.0 109.957 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -149.27 171.89 15.76 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.397 1.079 . . . . 0.0 108.527 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 t -100.82 125.26 54.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.5 p -96.52 170.47 9.19 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.521 1.129 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -77.72 -9.44 59.0 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.185 1.794 . . . . 0.0 112.961 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -70.19 97.46 1.21 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.858 1.263 . . . . 0.0 108.523 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -89.14 145.1 25.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 123.655 0.782 . . . . 0.0 109.672 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.95 142.77 33.91 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 126.514 1.926 . . . . 0.0 112.399 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.79 146.82 30.35 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 123.836 3.024 . . . . 0.0 109.728 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -53.99 -31.52 51.2 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.741 1.216 . . . . 0.0 113.874 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.72 -29.06 69.53 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.317 -0.864 . . . . 0.0 111.1 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -84.58 -15.46 45.57 Favored 'General case' 0 C--O 1.23 0.053 0 O-C-N 121.157 -0.964 . . . . 0.0 109.109 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 ' CD2' ' A' ' 90' ' ' TYR . 95.4 t -77.18 114.04 17.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 178.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.484 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.1 OUTLIER -68.09 -61.26 1.94 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 124.915 1.286 . . . . 0.0 109.5 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.2 169.47 20.71 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.402 1.001 . . . . 0.0 110.502 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 p -71.58 151.72 43.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD12 ' A' ' 82' ' ' LEU . 3.8 ttmt -118.58 -38.78 3.08 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.492 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 t -147.57 140.87 19.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 118.548 0.613 . . . . 0.0 111.905 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -113.88 93.95 4.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 125.596 1.558 . . . . 0.0 107.875 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -140.24 156.46 46.48 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 128.35 2.66 . . . . 0.0 105.549 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -131.01 126.49 36.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.291 1.836 . . . . 0.0 108.709 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE3' HD23 ' A' ' 71' ' ' LEU . 0.6 OUTLIER -147.37 129.99 15.96 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 tt -134.55 144.51 48.03 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.977 1.711 . . . . 0.0 108.175 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.45 169.88 23.6 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 125.918 1.687 . . . . 0.0 107.8 178.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -128.01 134.71 64.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 119.56 1.073 . . . . 0.0 108.343 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.63 133.68 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 125.061 1.344 . . . . 0.0 110.617 -178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -71.69 119.3 15.65 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.858 2.063 . . . . 0.0 108.506 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.1 mtp -68.72 -17.34 64.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.871 0.76 . . . . 0.0 112.684 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 7.4 mmpt? -79.81 -53.93 6.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.302 1.41 . . . . 0.0 112.47 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.6 m -97.31 -7.72 31.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 66.31 14.91 9.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.018 1.727 . . . . 0.0 110.846 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -99.11 155.25 17.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 125.631 1.572 . . . . 0.0 111.454 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.409 ' CD2' ' HA2' ' A' ' 14' ' ' GLY . 5.5 mp -74.0 157.46 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 177.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.7 mt -126.68 -174.4 3.12 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.794 1.238 . . . . 0.0 112.091 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -13.77 15.92 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.465 1.906 . . . . 0.0 113.525 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 p -149.37 -172.41 4.13 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.615 1.166 . . . . 0.0 108.505 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.5 t -113.86 106.82 14.9 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -109.41 164.41 12.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 125.187 1.395 . . . . 0.0 109.061 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -10.96 6.04 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.682 1.593 . . . . 0.0 114.732 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.03 14.71 20.81 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.583 1.083 . . . . 0.0 109.001 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 t -131.87 167.18 20.04 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.51 1.524 . . . . 0.0 109.898 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -140.87 135.23 33.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 125.215 1.406 . . . . 0.0 109.0 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 t -79.43 142.9 35.5 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.8 mt -132.85 133.16 42.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -113.16 103.44 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 103.228 -2.879 . . . . 0.0 103.228 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.504 HD23 ' HE3' ' A' ' 47' ' ' LYS . 1.9 mm? -97.93 91.89 5.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 -178.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.87 -163.76 0.74 Allowed 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -176.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 54.13 67.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.963 0.887 . . . . 0.0 112.109 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.7 mt -80.79 133.71 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.346 -0.846 . . . . 0.0 110.239 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -133.39 169.71 16.54 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.566 1.946 . . . . 0.0 110.093 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -117.66 150.31 39.26 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.881 2.072 . . . . 0.0 109.745 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.99 168.49 9.02 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 126.86 2.064 . . . . 0.0 110.214 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.5 m -53.85 -37.95 64.17 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.242 1.017 . . . . 0.0 113.449 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -85.76 11.91 10.1 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 126.136 1.775 . . . . 0.0 113.211 -177.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.7 mptt 74.73 1.21 3.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.921 1.689 . . . . 0.0 110.223 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.8 t -71.21 152.33 43.45 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 104.821 -2.288 . . . . 0.0 104.821 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -109.28 153.17 24.25 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.628 0.771 . . . . 0.0 109.744 -178.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.6 p -139.62 168.33 20.06 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.517 1.127 . . . . 0.0 109.647 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.9 ttm -133.83 138.35 45.6 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.075 1.75 . . . . 0.0 109.703 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.27 118.84 4.71 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 127.279 2.371 . . . . 0.0 111.184 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.7 mt -137.0 119.66 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 51.48 44.21 29.15 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.625 0.77 . . . . 0.0 109.264 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 56.6 m-20 62.41 17.83 9.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.054 2.142 . . . . 0.0 114.676 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -118.48 131.27 56.25 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 124.371 1.068 . . . . 0.0 109.113 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.409 ' CD2' HG21 ' A' ' 38' ' ' VAL . 14.2 m-85 -86.74 116.29 24.74 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 122.338 0.255 . . . . 0.0 111.031 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -109.08 123.63 49.48 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.272 2.229 . . . . 0.0 109.547 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -59.92 142.38 53.77 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.725 1.61 . . . . 0.0 111.289 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -110.45 133.66 55.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -129.36 163.42 46.45 Favored Pre-proline 0 N--CA 1.468 0.459 0 C-N-CA 125.886 1.675 . . . . 0.0 110.999 -177.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.59 152.22 37.82 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.68 2.253 . . . . 0.0 111.084 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.4 -6.34 4.72 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -15.44 59.69 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.63 -1.293 . . . . 0.0 110.929 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -73.01 -4.25 31.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -45.71 138.76 4.45 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 127.15 2.18 . . . . 0.0 111.06 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 101.77 -26.81 23.1 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.92 -18.62 8.16 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.402 1.081 . . . . 0.0 111.985 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -140.74 157.11 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -145.93 167.44 23.28 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 127.039 2.135 . . . . 0.0 107.767 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.18 162.46 5.86 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.258 0.623 . . . . 0.0 110.561 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.98 168.64 13.3 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.891 -0.506 . . . . 0.0 111.502 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -111.7 139.72 46.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.972 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.3 mp -68.82 -13.35 62.36 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 123.836 0.854 . . . . 0.0 111.019 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -60.27 -23.04 63.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.174 0.99 . . . . 0.0 111.943 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -71.47 -7.48 47.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.341 1.056 . . . . 0.0 110.99 -177.114 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.236 0.388 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.403 HG21 HD12 ' A' ' 74' ' ' ILE . 84.8 t -112.23 144.7 19.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -119.44 96.93 5.41 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -76.22 155.09 34.74 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.197 -2.149 . . . . 0.0 105.197 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -62.39 -33.33 74.55 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 74.41 123.95 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.919 2.088 . . . . 0.0 110.431 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.83 35.07 38.5 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.466 1.031 . . . . 0.0 113.533 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -140.17 -179.65 6.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.172 2.589 . . . . 0.0 109.335 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -72.67 -168.35 0.44 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.287 2.235 . . . . 0.0 111.27 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.277 22.0 p -79.21 118.18 20.91 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -176.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -169.28 140.5 2.36 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 126.781 2.032 . . . . 0.0 108.218 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.478 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.9 p90 -160.68 169.61 22.49 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.22 126.65 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 107.661 -1.236 . . . . 0.0 107.661 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -138.43 136.1 35.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.2 t0 55.16 41.39 31.59 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.011 1.325 . . . . 0.0 112.271 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 59.77 28.16 17.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.507 1.523 . . . . 0.0 111.644 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -130.95 142.76 50.38 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.403 1.081 . . . . 0.0 110.993 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.1 m -70.19 126.59 30.11 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.366 1.866 . . . . 0.0 107.767 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.478 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 5.5 m-85 -137.57 160.23 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.996 0.918 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.46 ' CE2' HG22 ' A' ' 29' ' ' THR . 21.8 p90 -149.63 165.29 32.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.998 0.919 . . . . 0.0 109.007 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' ILE . 41.5 t -94.65 128.64 45.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.916 -0.49 . . . . 0.0 109.779 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 27' ' ' PHE . 17.6 p -96.27 166.47 11.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.001 1.32 . . . . 0.0 111.962 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -76.87 -10.03 59.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.021 1.328 . . . . 0.0 112.443 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -71.69 98.94 2.02 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.396 1.479 . . . . 0.0 108.038 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -89.98 142.92 27.24 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.12 140.87 26.2 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.963 1.705 . . . . 0.0 107.966 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.26 149.18 50.91 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.247 1.965 . . . . 0.0 109.909 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -57.71 -23.55 52.35 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -73.14 -23.67 60.5 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.931 -0.481 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.47 -14.82 39.4 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.654 1.182 . . . . 0.0 109.976 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.98 122.73 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.21 -61.51 1.79 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.09 168.35 13.72 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.931 1.292 . . . . 0.0 110.569 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.1 p -65.14 160.36 21.41 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HE3' HD12 ' A' ' 82' ' ' LEU . 20.5 ttmm -128.21 -50.01 1.31 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 117.492 -1.242 . . . . 0.0 111.347 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -143.2 136.65 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 120.021 1.282 . . . . 0.0 111.691 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mtmm -104.24 114.83 29.34 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.613 1.965 . . . . 0.0 109.201 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -146.8 157.91 43.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 127.613 2.365 . . . . 0.0 108.988 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 108.29 5.65 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.274 0.943 . . . . 0.0 110.58 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.19 142.24 27.08 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.8 tt -135.15 145.27 47.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 127.979 2.512 . . . . 0.0 109.382 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.48 170.37 17.0 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.89 1.676 . . . . 0.0 108.755 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.98 136.73 59.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 125.49 1.516 . . . . 0.0 108.621 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -137.19 134.77 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.285 0.634 . . . . 0.0 109.956 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.587 ' HB2' HD11 ' A' ' 59' ' ' LEU . 11.4 t0 -79.81 125.35 29.59 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.403 1.081 . . . . 0.0 108.458 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 81.7 mtp -65.94 -16.22 63.67 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.965 1.257 . . . . 0.0 112.934 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -63.36 -53.79 47.03 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.094 0.861 . . . . 0.0 111.719 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 t -122.69 9.44 9.54 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 56.53 38.21 29.45 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.767 1.167 . . . . 0.0 110.085 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -105.86 143.03 34.58 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 125.223 1.409 . . . . 0.0 108.676 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.72 153.72 41.03 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.819 0.818 . . . . 0.0 111.092 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.587 HD11 ' HB2' ' A' ' 52' ' ' ASP . 31.7 mt -135.25 157.6 46.49 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.629 -1.168 . . . . 0.0 110.803 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.24 -20.88 33.7 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.815 1.246 . . . . 0.0 110.973 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 m -149.22 140.32 23.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.077 0.951 . . . . 0.0 108.454 -178.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.64 119.0 19.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.551 1.54 . . . . 0.0 110.404 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -107.28 172.0 7.07 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 126.329 1.852 . . . . 0.0 107.438 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -56.74 -26.45 57.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.717 1.376 . . . . 0.0 114.717 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -92.86 4.17 54.36 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.491 0.716 . . . . 0.0 111.754 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 43.0 t -117.62 166.69 12.1 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.569 1.548 . . . . 0.0 113.314 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.5 t -137.53 148.25 25.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 127.046 2.139 . . . . 0.0 106.545 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -101.91 143.4 31.85 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -130.86 136.82 49.0 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 t -116.04 101.96 12.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.72 96.7 9.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.915 1.286 . . . . 0.0 107.957 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.58 -161.76 0.25 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 118.41 0.55 . . . . 0.0 112.398 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 52.42 66.76 1.12 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.639 1.976 . . . . 0.0 112.281 176.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.403 HD12 HG21 ' A' ' 9' ' ' VAL . 2.3 mt -81.55 135.12 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.184 -0.948 . . . . 0.0 111.277 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -139.36 161.97 36.15 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.637 1.975 . . . . 0.0 109.729 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -104.67 155.43 18.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.517 1.527 . . . . 0.0 108.606 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.59 163.92 12.82 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.419 1.887 . . . . 0.0 109.75 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.1 p -57.76 -34.2 69.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.378 0.671 . . . . 0.0 112.809 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -80.55 11.63 3.62 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.038 0.935 . . . . 0.0 110.582 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 71.19 12.04 6.83 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 127.878 2.471 . . . . 0.0 110.29 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.13 167.14 20.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.433 HD12 ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -119.12 148.4 43.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.637 1.175 . . . . 0.0 109.553 -178.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 17.5 p -147.2 167.23 24.72 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.476 0.71 . . . . 0.0 110.161 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.4 ttm -133.85 137.55 45.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 126.313 1.845 . . . . 0.0 108.198 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.54 121.2 5.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 125.298 1.428 . . . . 0.0 109.82 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.0 mt -136.72 120.62 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 51.42 51.22 17.26 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.586 1.954 . . . . 0.0 110.103 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t0 59.86 15.89 5.26 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.015 1.726 . . . . 0.0 114.134 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -121.09 139.18 53.67 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 125.266 1.426 . . . . 0.0 109.389 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -96.72 116.43 29.12 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 118.331 0.514 . . . . 0.0 111.391 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -106.89 125.84 51.53 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.26 1.424 . . . . 0.0 109.491 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -60.71 146.32 46.22 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.155 0.982 . . . . 0.0 109.697 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 28' ' ' VAL . 1.3 pt -115.9 132.93 63.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -129.19 165.16 34.34 Favored Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 124.713 1.205 . . . . 0.0 112.33 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.96 148.81 32.14 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.819 2.346 . . . . 0.0 110.176 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -58.65 -15.32 11.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.404 0.682 . . . . 0.0 112.703 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.2 m -72.66 -14.91 61.69 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 120.762 -1.211 . . . . 0.0 112.055 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.42 -4.07 43.48 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.799 -1.188 . . . . 0.0 111.445 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -53.96 150.24 8.07 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.994 1.318 . . . . 0.0 108.941 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.6 1.81 63.7 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -148.86 -49.89 0.15 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.018 2.527 . . . . 0.0 106.259 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 t -109.3 161.51 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.152 0.981 . . . . 0.0 109.068 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -150.67 170.51 19.01 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 127.097 2.159 . . . . 0.0 108.864 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.62 169.11 2.54 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.203 1.001 . . . . 0.0 112.174 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.31 174.94 9.57 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.587 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.1 mtt85 -125.12 141.69 51.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 O-C-N 121.887 -0.508 . . . . 0.0 110.79 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.579 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.4 OUTLIER -63.12 -22.04 66.59 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.312 1.045 . . . . 0.0 110.936 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -57.29 -16.57 8.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -76.77 -3.11 36.52 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.336 0.655 . . . . 0.0 110.495 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.253 1.252 0 C-N-CA 127.719 2.408 . . . . 0.0 107.729 -178.987 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? . . . . . 0 C--O 1.234 0.271 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -104.07 130.45 54.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -98.23 111.94 24.09 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -87.04 158.88 19.13 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.85 -33.93 75.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 75.2 128.11 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.352 2.261 . . . . 0.0 112.348 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.99 34.83 39.32 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 125.737 1.637 . . . . 0.0 112.249 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.9 m -139.89 178.47 7.23 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 125.928 1.691 . . . . 0.0 112.096 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -73.65 -169.45 0.7 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.116 1.767 . . . . 0.0 108.764 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.6 p -79.67 120.88 24.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 119.658 -1.901 . . . . 0.0 110.574 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -168.23 144.41 3.84 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 130.172 3.389 . . . . 0.0 106.596 178.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 31.7 p90 -165.79 165.43 18.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.5 mp -120.57 131.3 73.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 123.784 0.834 . . . . 0.0 109.148 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -144.45 143.91 31.12 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 50.64 34.31 9.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 112.638 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 58.01 33.52 23.28 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 112.384 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -130.61 146.3 52.09 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.062 1.745 . . . . 0.0 106.864 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 m -74.44 140.81 44.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.8 m-85 -139.54 159.23 42.65 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 125.643 1.577 . . . . 0.0 109.523 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -148.91 165.69 30.8 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.021 -1.05 . . . . 0.0 109.799 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.9 t -101.26 128.24 53.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 p -99.71 172.39 7.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.356 1.462 . . . . 0.0 109.05 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -78.05 -15.58 58.79 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.624 1.97 . . . . 0.0 112.273 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -67.31 116.33 7.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.514 1.126 . . . . 0.0 110.681 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.24 148.26 23.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.969 1.708 . . . . 0.0 111.47 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.489 HD11 ' CD ' ' A' ' 92' ' ' LYS . 23.6 mm -116.4 127.77 26.5 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 126.594 1.958 . . . . 0.0 109.419 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.63 146.74 68.25 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.7 2.267 . . . . 0.0 109.477 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -55.93 -27.64 53.2 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.6 -23.78 67.52 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.535 0.734 . . . . 0.0 111.574 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -95.12 -19.07 20.41 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.63 139.21 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.438 ' ND2' HD22 ' A' ' 40' ' ' ASN . 0.2 OUTLIER -93.36 -60.94 1.66 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.258 -179.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.438 HD22 ' ND2' ' A' ' 39' ' ' ASN . 6.7 p30 -163.43 166.04 23.22 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.65 0.78 . . . . 0.0 111.668 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 p -70.76 126.74 30.42 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -101.51 -42.16 6.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 55.3 t -142.64 127.95 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 119.105 0.866 . . . . 0.0 108.877 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -100.38 117.37 34.43 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -149.93 157.08 42.82 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 131.282 3.833 . . . . 0.0 105.197 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -137.21 115.39 11.67 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 104.052 -2.574 . . . . 0.0 104.052 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -146.77 133.52 20.01 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.6 tt -137.58 145.63 43.08 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.876 1.67 . . . . 0.0 108.215 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.88 169.31 25.06 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 125.909 1.683 . . . . 0.0 106.48 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.5 mt -127.97 137.41 57.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 C-N-CA 125.617 1.567 . . . . 0.0 107.111 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -130.55 140.22 49.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.71 126.98 33.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 84.2 mtp -67.62 -18.69 65.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -72.22 -44.61 62.67 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -122.13 0.84 9.68 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.61 30.28 18.56 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.885 1.274 . . . . 0.0 111.068 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -99.05 147.05 25.43 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.88 0.872 . . . . 0.0 110.0 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.91 146.95 43.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mp -124.43 177.58 5.83 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.379 1.472 . . . . 0.0 110.397 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 t -116.9 -3.25 11.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.978 1.311 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 p -144.7 162.34 36.96 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 120.219 1.372 . . . . 0.0 109.129 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.8 t -92.76 115.4 28.08 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -124.44 161.59 25.71 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -56.45 -19.93 17.49 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -93.08 -4.33 52.58 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.92 0.888 . . . . 0.0 110.753 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 m -113.7 160.09 19.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.484 1.514 . . . . 0.0 113.771 -176.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 25.3 t -137.07 146.59 27.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 125.191 1.397 . . . . 0.0 108.826 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -85.75 141.37 29.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -129.98 100.75 5.56 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 105.887 -1.894 . . . . 0.0 105.887 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.87 102.41 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 103.203 -2.888 . . . . 0.0 103.203 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.32 93.71 8.35 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.656 -0.418 . . . . 0.0 112.005 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 47.1 67.38 0.8 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.012 1.725 . . . . 0.0 111.723 177.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.2 mt -77.45 140.12 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.538 -1.351 . . . . 0.0 109.591 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -134.15 169.67 16.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.753 2.021 . . . . 0.0 111.01 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -113.06 170.8 7.95 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.017 2.127 . . . . 0.0 109.601 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.61 161.24 26.67 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.747 2.019 . . . . 0.0 108.272 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -60.57 -26.88 67.27 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.504 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -93.53 28.49 2.27 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.49 1.916 . . . . 0.0 111.32 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 59.35 3.19 0.36 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.328 1.851 . . . . 0.0 112.93 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.7 m -73.49 152.86 40.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.49 150.09 35.37 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.297 0.639 . . . . 0.0 110.773 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.0 p -144.69 169.44 18.0 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.901 0.88 . . . . 0.0 110.619 178.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.0 ttm -134.46 136.24 43.06 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 126.391 1.876 . . . . 0.0 109.328 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.48 110.38 3.28 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 125.502 1.525 . . . . 0.0 111.439 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.2 mt -123.68 119.16 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 49.49 51.81 15.69 Favored 'General case' 0 C--O 1.23 0.076 0 C-N-CA 124.689 1.195 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 70.31 -6.22 1.2 Allowed 'General case' 0 C--O 1.24 0.561 0 C-N-CA 128.046 2.538 . . . . 0.0 115.525 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -105.41 133.74 49.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.396 1.453 . . . . 0.0 110.646 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -85.67 116.66 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.455 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -115.85 132.53 56.61 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.504 1.122 . . . . 0.0 112.219 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.587 ' HE3' HD21 ' A' ' 94' ' ' LEU . 2.2 mtpp -60.53 142.38 55.41 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.833 1.253 . . . . 0.0 111.19 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.7 135.5 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.587 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.0 mm? -130.18 159.3 71.01 Favored Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 123.954 0.902 . . . . 0.0 108.818 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.0 161.18 45.32 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.312 2.008 . . . . 0.0 109.831 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.17 -13.07 32.77 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 110.472 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -63.34 -24.36 67.82 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.216 1.806 . . . . 0.0 109.555 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -10.69 59.99 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.828 1.251 . . . . 0.0 111.183 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.9 mmtt -59.26 161.49 5.42 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 120.682 -1.261 . . . . 0.0 109.941 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.7 -35.11 4.18 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -124.15 -5.92 7.81 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.3 t -135.51 156.81 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 126.515 1.926 . . . . 0.0 105.863 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -138.6 165.45 26.87 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.892 1.677 . . . . 0.0 108.131 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.88 166.42 15.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.02 167.31 10.04 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -106.89 132.29 53.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 125.886 1.674 . . . . 0.0 110.474 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mt -67.38 -21.41 65.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.311 0.644 . . . . 0.0 109.984 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -60.07 -20.42 58.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.901 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -67.09 -16.93 64.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.97 0.804 . . . . 0.0 112.293 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.691 1.996 . . . . 0.0 111.33 -177.387 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.7 t -64.44 143.71 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 O-C-N 121.825 -0.547 . . . . 0.0 110.183 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -117.12 105.6 12.44 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -84.63 153.61 23.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -67.18 -33.96 76.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.571 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 63.31 135.62 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.93 3.292 . . . . 0.0 112.408 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.95 24.35 74.4 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m -138.83 178.64 7.01 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.706 2.002 . . . . 0.0 112.286 -178.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.44 -169.02 0.6 Allowed 'General case' 0 C--O 1.24 0.599 0 C-N-CA 129.096 2.958 . . . . 0.0 107.694 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.258 35.2 p -79.32 119.39 22.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 117.534 -1.666 . . . . 0.0 108.324 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -169.2 147.74 3.83 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 130.212 3.405 . . . . 0.0 107.033 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -168.13 171.41 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 126.351 1.86 . . . . 0.0 107.979 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -126.68 127.74 70.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 42.7 t80 -141.08 147.24 38.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 4.9 t70 54.92 32.15 17.35 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.252 1.821 . . . . 0.0 109.691 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 66.64 15.56 10.15 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 127.576 2.35 . . . . 0.0 113.357 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -123.66 154.77 38.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 124.395 1.078 . . . . 0.0 109.588 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.1 t -79.34 141.93 36.52 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -144.59 155.78 43.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.711 2.004 . . . . 0.0 111.493 -178.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -148.8 151.23 34.42 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 120.904 -1.122 . . . . 0.0 110.529 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 t -81.11 127.96 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 123.997 0.919 . . . . 0.0 110.626 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.3 p -98.14 164.4 12.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.803 1.241 . . . . 0.0 109.035 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.68 -12.37 61.3 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 126.506 1.922 . . . . 0.0 113.295 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.95 112.31 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.584 1.553 . . . . 0.0 109.208 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.402 ' C ' HD12 ' A' ' 33' ' ' ILE . 16.7 tt0 -96.83 146.92 24.46 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.719 0.808 . . . . 0.0 109.451 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.402 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.04 135.22 22.08 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.604 1.962 . . . . 0.0 109.139 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.3 151.58 29.88 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.452 2.768 . . . . 0.0 111.564 178.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -58.5 -22.6 55.59 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.528 0.731 . . . . 0.0 112.749 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -67.45 -25.84 66.1 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.937 -0.477 . . . . 0.0 110.517 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -90.63 -20.01 23.02 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 111.399 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.1 t -65.13 126.15 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.49 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -83.47 -61.3 1.88 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.733 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.449 HD22 ' ND2' ' A' ' 39' ' ' ASN . 4.5 p30 -163.87 168.95 18.86 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 126.159 1.783 . . . . 0.0 109.16 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.441 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 15.9 m -63.16 155.35 28.36 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.155 0.982 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -120.42 -54.73 2.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.737 -0.602 . . . . 0.0 110.592 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.2 t -146.99 146.81 18.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.58 125.38 53.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 104.047 -2.575 . . . . 0.0 104.047 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 158.43 44.06 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 126.274 1.83 . . . . 0.0 111.343 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.87 112.83 15.15 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.859 ' HE3' HD23 ' A' ' 49' ' ' LEU . 4.0 tmtm? -147.99 115.9 6.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.45 1.1 . . . . 0.0 109.113 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -131.78 134.77 46.2 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.112 1.365 . . . . 0.0 107.823 178.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.859 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -148.53 170.97 16.88 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.853 1.661 . . . . 0.0 108.425 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -129.28 129.6 67.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.5 t -120.93 134.03 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.67 1.188 . . . . 0.0 108.966 -178.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' A' ' 59' ' ' LEU . 3.9 t70 -80.68 126.03 30.77 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.03 -1.043 . . . . 0.0 109.574 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 76.5 mtp -68.23 -17.79 64.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.608 1.549 . . . . 0.0 113.808 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -65.0 -52.03 58.37 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.164 0.893 . . . . 0.0 111.094 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -122.19 6.25 9.71 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 60.66 24.79 14.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.484 1.514 . . . . 0.0 112.353 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.557 ' HE3' ' HA ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -93.27 151.15 19.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 120.931 -1.106 . . . . 0.0 109.157 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.485 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -70.8 146.21 49.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' A' ' 52' ' ' ASP . 50.6 mt -130.42 -179.59 5.35 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.328 2.251 . . . . 0.0 108.253 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.8 m -131.78 -5.06 3.62 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.693 1.197 . . . . 0.0 112.281 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -123.71 174.63 7.36 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.041 1.736 . . . . 0.0 106.963 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 t -109.28 110.44 21.63 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.262 87.5 m-20 -102.65 159.38 15.51 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.355 1.462 . . . . 0.0 107.747 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -70.52 -12.87 61.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.211 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -100.62 5.52 43.9 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.439 1.472 . . . . 0.0 110.55 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.7 t -113.78 173.75 6.27 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.012 1.725 . . . . 0.0 112.053 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.5 t -142.59 130.41 19.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 125.731 1.612 . . . . 0.0 107.784 178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -75.04 135.09 41.27 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.409 ' HA ' HD21 ' A' ' 87' ' ' ASN . 86.1 mt -125.84 132.33 52.24 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 120.8 -1.187 . . . . 0.0 108.332 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -113.31 107.84 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.53 92.04 3.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.909 1.232 . . . . 0.0 110.981 -178.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.14 -164.34 0.53 Allowed 'General case' 0 CA--C 1.508 -0.672 0 O-C-N 121.199 -0.938 . . . . 0.0 111.736 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.94 66.79 0.87 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 123.882 0.739 . . . . 0.0 111.636 176.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 6.7 mt -79.61 138.61 19.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.3 m-85 -134.69 168.83 18.3 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.13 1.772 . . . . 0.0 107.768 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -110.9 157.9 19.34 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.486 1.514 . . . . 0.0 108.141 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.77 162.59 17.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 125.348 1.459 . . . . 0.0 109.457 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.1 t -56.42 -29.98 62.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.486 0.714 . . . . 0.0 111.098 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -85.08 12.29 8.04 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.82 -1.175 . . . . 0.0 112.517 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm 75.3 1.99 3.79 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.546 1.939 . . . . 0.0 110.462 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 m -74.72 167.69 21.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.439 1.096 . . . . 0.0 110.108 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.78 148.58 45.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.492 1.117 . . . . 0.0 110.204 -178.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.4 p -140.2 171.07 14.69 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.08 0.952 . . . . 0.0 109.414 178.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.5 ttm -131.36 134.65 46.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.357 1.863 . . . . 0.0 110.718 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.24 103.78 2.53 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 126.743 2.116 . . . . 0.0 110.573 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 65.7 mt -117.43 113.97 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.899 1.68 . . . . 0.0 108.074 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.409 HD21 ' HA ' ' A' ' 69' ' ' LEU . 71.4 m-80 47.84 54.01 10.57 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 124.743 1.217 . . . . 0.0 112.585 178.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 75.21 -4.64 2.33 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.518 1.927 . . . . 0.0 115.473 178.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -115.85 147.48 40.99 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.378 1.445 . . . . 0.0 109.626 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -99.85 116.92 33.04 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -108.09 133.44 52.37 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.964 1.305 . . . . 0.0 111.176 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -67.87 151.09 47.72 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.19 -0.944 . . . . 0.0 110.059 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -118.58 133.66 64.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -119.59 156.75 53.25 Favored Pre-proline 0 N--CA 1.467 0.39 0 C-N-CA 125.238 1.415 . . . . 0.0 108.848 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.51 156.1 64.93 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.483 2.122 . . . . 0.0 109.888 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.36 65.18 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.577 -0.702 . . . . 0.0 109.68 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.0 t -70.88 -0.7 9.71 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.107 0.963 . . . . 0.0 110.516 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.97 -3.77 31.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.033 -1.667 . . . . 0.0 112.959 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -53.05 164.41 0.41 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.606 1.193 . . . . 0.0 112.701 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.62 -41.77 3.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 125.118 1.342 . . . . 0.0 111.823 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.75 -28.24 19.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.417 1.087 . . . . 0.0 110.573 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.9 p -134.02 162.9 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 127.38 2.272 . . . . 0.0 106.402 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -134.39 172.56 12.72 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.818 2.447 . . . . 0.0 106.875 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.68 168.71 14.3 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.23 172.51 6.85 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.711 -0.618 . . . . 0.0 112.46 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -118.22 138.88 52.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.341 1.056 . . . . 0.0 110.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.403 HD12 ' H ' ' A' ' 107' ' ' LEU . 1.6 mp -70.85 -13.13 61.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.162 0.585 . . . . 0.0 110.04 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -61.48 -10.13 7.11 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.243 2.217 . . . . 0.0 113.18 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -96.1 -4.65 42.45 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.726 0.81 . . . . 0.0 112.706 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 C--O 1.25 1.099 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.226 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.2 t -99.13 137.15 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -102.46 103.05 13.4 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 103.688 -2.708 . . . . 0.0 103.688 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -80.59 166.63 20.94 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.493 1.117 . . . . 0.0 110.697 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 2.2 p30 -59.24 -33.58 71.18 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.709 1.604 . . . . 0.0 113.798 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 51.19 91.96 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.101 2.56 . . . . 0.0 113.477 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 65.07 38.7 95.67 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 113.748 -1.569 . . . . 0.0 111.904 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 5.0 m -139.38 -179.89 6.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.349 2.259 . . . . 0.0 109.647 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.66 -170.07 0.8 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.617 1.567 . . . . 0.0 108.358 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 33.8 p -79.49 121.76 25.6 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 123.994 1.854 . . . . 0.0 110.438 -175.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -167.14 149.42 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 129.584 3.154 . . . . 0.0 107.234 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.47 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 38.8 p90 -164.27 167.27 20.11 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -131.53 112.83 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 O-C-N 120.452 -1.405 . . . . 0.0 108.278 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.416 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 86.9 t80 -117.55 137.07 52.83 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.067 0.947 . . . . 0.0 108.608 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.416 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 3.3 t70 55.25 34.22 22.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.175 1.79 . . . . 0.0 114.042 179.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 69.78 17.65 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.844 2.458 . . . . 0.0 111.933 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -119.08 138.24 53.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.963 1.705 . . . . 0.0 106.944 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.2 m -82.42 136.95 34.83 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -137.67 166.41 24.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.561 1.944 . . . . 0.0 112.125 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -148.99 163.66 36.86 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.495 0.718 . . . . 0.0 110.725 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 t -96.01 122.52 47.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 124.785 1.234 . . . . 0.0 108.466 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.78 172.82 7.01 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.517 1.127 . . . . 0.0 110.009 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -74.9 -14.98 60.71 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HE2' HG23 ' A' ' 102' ' ' VAL . 0.0 OUTLIER -69.51 110.95 5.03 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.065 0.946 . . . . 0.0 110.315 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.19 146.81 24.38 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.36 1.064 . . . . 0.0 108.524 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.6 mp -117.71 137.17 24.02 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 126.528 1.931 . . . . 0.0 105.946 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.6 153.05 49.02 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.447 2.098 . . . . 0.0 111.47 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.21 -30.19 64.36 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -65.9 -15.6 63.09 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.783 0.719 . . . . 0.0 112.686 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -97.9 -14.44 20.67 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.988 0.915 . . . . 0.0 111.14 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.405 HG21 ' CD2' ' A' ' 90' ' ' TYR . 69.9 t -78.23 135.35 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 C-N-CA 124.602 1.161 . . . . 0.0 108.001 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.66 -61.34 1.66 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.359 1.464 . . . . 0.0 111.038 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -156.23 158.71 38.01 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.7 t -70.45 131.43 44.04 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttp -101.12 -51.93 3.4 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 117.153 -1.403 . . . . 0.0 114.535 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.9 t -141.39 133.48 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 119.027 0.831 . . . . 0.0 110.191 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.21 117.2 33.43 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.335 1.054 . . . . 0.0 109.445 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -148.77 157.44 43.44 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.628 1.971 . . . . 0.0 110.128 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -123.3 120.71 33.88 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.963 -1.085 . . . . 0.0 108.398 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.4 tptm -147.51 124.02 11.05 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.725 1.21 . . . . 0.0 107.818 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 tt -134.19 143.96 48.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.623 1.969 . . . . 0.0 109.407 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -153.72 169.57 23.0 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 125.369 1.468 . . . . 0.0 107.838 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mt -130.33 133.82 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 125.192 1.397 . . . . 0.0 107.443 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.19 152.49 33.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 125.738 1.615 . . . . 0.0 108.129 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -88.89 124.83 34.58 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.347 1.859 . . . . 0.0 107.327 178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.9 mtp -68.35 -25.95 65.35 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 121.009 1.731 . . . . 0.0 109.863 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -53.56 54.09 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.362 1.065 . . . . 0.0 112.677 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -111.34 -6.14 14.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 65.0 20.2 12.05 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.819 1.19 . . . . 0.0 111.308 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -102.27 153.89 19.55 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.79 1.636 . . . . 0.0 108.637 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.77 154.59 39.51 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.335 0.516 . . . . 0.0 111.393 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.2 mt -135.56 160.28 38.98 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 125.791 1.636 . . . . 0.0 108.809 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -7.98 45.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.4 m -142.18 165.57 27.08 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.737 1.608 . . . . 0.0 110.071 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.4 p -92.39 117.01 29.48 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -132.23 163.06 29.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -47.38 -34.59 7.2 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -178.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -80.08 -7.1 58.71 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.829 -1.169 . . . . 0.0 112.634 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.8 t -120.55 164.28 16.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 127.346 2.258 . . . . 0.0 114.035 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -137.32 161.38 34.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 127.012 2.125 . . . . 0.0 106.353 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.1 t -110.87 144.84 39.29 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.016 1.327 . . . . 0.0 109.487 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.1 mt -131.19 144.72 51.56 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.0 t -122.94 101.73 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 101.658 -3.46 . . . . 0.0 101.658 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -87.87 96.07 10.34 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -178.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.01 -161.62 0.33 Allowed 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.59 66.93 1.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.639 1.576 . . . . 0.0 111.455 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 mt -79.36 137.1 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.166 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -134.99 168.86 18.34 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.967 1.707 . . . . 0.0 109.212 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -116.96 147.1 42.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.31 168.47 10.0 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 126.251 1.82 . . . . 0.0 110.637 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.9 t -60.31 -35.15 74.93 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -83.15 18.2 1.78 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.986 1.314 . . . . 0.0 112.178 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 65.26 12.5 8.09 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.256 1.422 . . . . 0.0 110.43 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.8 t -81.29 169.29 17.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.4 mt -123.55 154.99 38.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.413 0.685 . . . . 0.0 112.377 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.4 p -146.98 171.78 14.72 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.901 0.88 . . . . 0.0 110.035 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.2 ttm -133.58 135.98 44.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.368 1.867 . . . . 0.0 108.651 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.0 115.74 4.17 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 126.174 1.845 . . . . 0.0 112.865 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -132.76 122.84 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 55.7 36.92 28.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.39 1.876 . . . . 0.0 110.777 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 t0 70.02 13.82 7.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.14 2.176 . . . . 0.0 114.173 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -116.48 138.54 51.3 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.843 1.657 . . . . 0.0 107.823 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD2' HG21 ' A' ' 38' ' ' VAL . 18.6 m-85 -91.2 116.88 29.17 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.798 -0.564 . . . . 0.0 110.448 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -106.07 124.56 49.77 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.224 1.409 . . . . 0.0 107.597 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.401 ' HB2' HD13 ' A' ' 33' ' ' ILE . 11.1 ttpp -60.53 157.51 14.1 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.157 -0.964 . . . . 0.0 111.307 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.47 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -121.99 134.54 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.01 158.74 67.87 Favored Pre-proline 0 N--CA 1.469 0.484 0 C-N-CA 125.093 1.357 . . . . 0.0 107.877 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.08 153.69 67.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.161 1.907 . . . . 0.0 109.171 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 99' ' ' LYS . 17.2 pt-20 -65.53 -19.79 66.07 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 119.892 -0.723 . . . . 0.0 110.747 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -63.82 -19.46 65.04 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.266 1.426 . . . . 0.0 110.894 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -84.88 2.17 43.84 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 96' ' ' GLU . 36.3 mtmt -55.5 154.6 6.25 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.883 0.765 . . . . 0.0 110.033 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.76 -21.72 35.7 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.078 0.847 . . . . 0.0 111.83 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.15 -12.43 6.91 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 118.86 1.33 . . . . 0.0 111.182 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.416 HG23 ' HE2' ' A' ' 31' ' ' LYS . 3.8 p -141.35 155.86 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 C-N-CA 125.655 1.582 . . . . 0.0 107.286 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -130.06 164.73 23.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.999 1.72 . . . . 0.0 108.211 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 164.6 12.99 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.48 160.0 11.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.386 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -107.35 133.18 52.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 124.217 1.007 . . . . 0.0 111.275 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.47 -23.06 67.15 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.759 1.224 . . . . 0.0 110.041 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.11 -9.2 2.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.042 1.337 . . . . 0.0 113.664 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -84.43 -8.04 59.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.18 0.992 . . . . 0.0 111.053 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 C--O 1.245 0.86 0 C-N-CA 124.367 1.067 . . . . 0.0 111.17 -176.602 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.536 0.438 0 CA-C-O 121.507 0.67 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.6 t -102.47 115.75 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 102.476 -3.157 . . . . 0.0 102.476 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -80.49 113.75 18.89 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.24 150.5 25.41 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -71.56 -34.05 69.63 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 119.636 -0.826 . . . . 0.0 111.358 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 66.51 137.44 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 128.174 2.59 . . . . 0.0 112.508 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.9 26.04 39.61 Favored Glycine 0 CA--C 1.533 1.172 0 O-C-N 121.294 -0.879 . . . . 0.0 113.202 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 m -140.26 177.68 7.82 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.519 1.928 . . . . 0.0 111.291 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.06 -168.33 0.61 Allowed 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.564 2.345 . . . . 0.0 107.025 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -79.85 121.87 25.95 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.781 -1.824 . . . . 0.0 110.113 -176.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -167.26 146.68 5.2 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 130.792 3.637 . . . . 0.0 105.646 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -168.79 167.4 11.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.259 1.424 . . . . 0.0 108.226 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.5 mt -130.92 113.22 23.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 O-C-N 121.595 -0.691 . . . . 0.0 109.251 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -120.01 139.98 51.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 53.27 33.2 14.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 123.029 1.395 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 56.84 30.14 17.32 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.034 2.534 . . . . 0.0 111.632 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.9 mtpp -123.16 132.37 54.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.682 1.993 . . . . 0.0 105.634 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.5 p -71.45 139.67 49.73 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -145.66 163.08 35.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.156 1.782 . . . . 0.0 109.385 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 p90 -149.14 162.02 40.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -95.75 127.04 48.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.407 HG21 HD23 ' A' ' 94' ' ' LEU . 26.3 p -96.57 171.86 8.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.693 1.597 . . . . 0.0 110.574 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.42 -10.25 59.35 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.542 1.937 . . . . 0.0 112.41 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.09 103.55 1.56 Allowed 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 126.081 1.752 . . . . 0.0 110.173 -179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.418 ' C ' HD12 ' A' ' 33' ' ' ILE . 31.3 tt0 -94.29 142.25 27.63 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.418 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.9 mp -116.21 142.63 29.62 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 124.331 1.052 . . . . 0.0 109.389 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 33' ' ' ILE . 96.0 Cg_endo -77.9 150.62 27.05 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.649 2.899 . . . . 0.0 110.408 178.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -54.37 -29.99 50.39 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -63.36 -19.96 65.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.264 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -97.69 -14.05 21.12 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.417 0.553 . . . . 0.0 111.749 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.62 119.84 25.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.458 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -77.24 -61.49 1.97 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.394 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.56 173.74 15.06 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.074 0.95 . . . . 0.0 110.809 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.496 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -63.21 163.47 10.24 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.7 1.2 . . . . 0.0 111.452 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -134.1 -53.19 0.85 Allowed 'General case' 0 CA--C 1.518 -0.261 0 O-C-N 121.075 -1.016 . . . . 0.0 109.241 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -144.68 132.33 16.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -108.46 92.65 4.14 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.541 1.162 . . . . 0.0 109.569 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -132.09 156.49 46.23 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 128.345 2.658 . . . . 0.0 105.738 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -134.94 118.3 16.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.494 1.918 . . . . 0.0 108.281 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.607 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -146.71 137.62 24.04 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -134.63 145.58 48.74 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.641 1.977 . . . . 0.0 107.839 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -151.54 170.29 20.01 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 107.302 179.325 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.443 ' O ' HD13 ' A' ' 58' ' ' LEU . 39.5 mt -127.5 128.79 70.17 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.154 0 C-N-CA 123.316 0.646 . . . . 0.0 109.329 -177.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.78 137.09 51.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 125.464 1.506 . . . . 0.0 110.554 -178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.88 117.04 23.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 129.284 3.034 . . . . 0.0 111.784 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 70.3 mtp -68.2 -14.49 63.02 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.683 -1.261 . . . . 0.0 112.247 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -69.74 -53.32 18.96 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.827 -1.17 . . . . 0.0 111.53 178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.8 m -122.79 10.53 9.6 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 58.95 21.08 8.82 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.178 1.391 . . . . 0.0 112.873 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 mtmm -96.81 161.73 13.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 123.742 0.817 . . . . 0.0 110.59 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.5 mm? -82.95 153.61 24.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.1 mt -135.18 160.93 36.8 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.696 1.198 . . . . 0.0 110.437 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -78.84 -25.8 44.11 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.04 0.536 . . . . 0.0 110.4 177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.27 158.66 43.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.505 1.122 . . . . 0.0 108.906 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.09 116.5 27.41 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.78 173.84 9.18 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -63.23 -18.59 63.7 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.137 -0.977 . . . . 0.0 112.238 177.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -103.6 18.18 22.45 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.458 1.503 . . . . 0.0 109.758 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.34 158.57 33.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.246 1.818 . . . . 0.0 108.609 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.0 t -133.31 145.58 33.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 125.068 1.347 . . . . 0.0 107.572 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -93.7 137.23 33.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.66 136.25 49.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 t -107.58 103.35 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 102.998 -2.964 . . . . 0.0 102.998 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.402 ' CD2' HD11 ' A' ' 49' ' ' LEU . 2.8 mm? -95.9 92.19 6.39 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 -166.06 0.89 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 51.67 67.49 0.95 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 122.557 1.17 . . . . 0.0 112.314 176.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.83 134.35 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.984 -1.073 . . . . 0.0 109.957 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 40.9 m-85 -135.16 169.86 16.8 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.735 2.014 . . . . 0.0 110.452 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -112.93 159.79 18.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.144 2.178 . . . . 0.0 109.866 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.76 169.56 9.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.218 1.407 . . . . 0.0 110.593 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -25.36 63.49 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.44 0.696 . . . . 0.0 112.011 179.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -98.8 15.15 26.32 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.09 -1.006 . . . . 0.0 112.338 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp 71.69 2.32 4.24 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.969 1.708 . . . . 0.0 112.617 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.7 m -70.28 159.36 34.2 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -114.04 156.66 23.71 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.26 -0.9 . . . . 0.0 111.046 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -143.77 170.96 14.89 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.158 0.983 . . . . 0.0 110.088 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.5 ttm -134.59 137.37 43.68 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 126.618 1.967 . . . . 0.0 108.982 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.86 124.11 6.38 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 126.194 1.854 . . . . 0.0 109.98 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.5 mt -144.18 120.87 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 53.1 45.5 28.58 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.545 0.738 . . . . 0.0 110.843 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.6 t0 60.33 17.65 7.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.52 1.928 . . . . 0.0 113.995 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.1 137.48 54.91 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 126.27 1.828 . . . . 0.0 108.269 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.58 116.99 29.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 122.488 0.315 . . . . 0.0 110.773 -178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -106.19 125.78 51.42 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.288 1.435 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -62.66 145.35 54.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.713 0.805 . . . . 0.0 110.75 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.76 133.01 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 106.079 -1.823 . . . . 0.0 106.079 179.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.407 HD23 HG21 ' A' ' 29' ' ' THR . 4.4 mm? -124.99 156.57 69.03 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.557 1.143 . . . . 0.0 109.777 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.08 141.64 33.09 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 N-CA-C 107.301 -1.846 . . . . 0.0 107.301 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -58.96 -13.75 7.31 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.7 t -68.8 -16.35 63.77 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.65 -6.2 54.87 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 119.638 1.108 . . . . 0.0 113.473 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -56.03 157.69 4.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.886 0.851 . . . . 0.0 109.719 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.93 -23.5 35.75 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 108.353 -1.899 . . . . 0.0 108.353 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.95 -7.35 13.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.004 2.121 . . . . 0.0 109.393 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 p -156.98 158.01 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 129.083 2.953 . . . . 0.0 105.242 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -135.6 170.66 15.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.979 1.712 . . . . 0.0 106.732 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.1 162.74 11.14 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.541 0.686 . . . . 0.0 110.979 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.643 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.17 163.2 3.87 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.498 -179.223 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.643 ' N ' HD12 ' A' ' 105' ' ' LEU . 40.9 mtm180 -116.48 139.14 50.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 124.289 1.036 . . . . 0.0 111.684 -177.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.51 -19.62 62.17 Favored 'General case' 0 C--O 1.22 -0.464 0 O-C-N 123.963 0.789 . . . . 0.0 110.797 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.2 -2.88 2.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.417 1.887 . . . . 0.0 113.158 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -93.71 0.57 56.47 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.039 -1.038 . . . . 0.0 110.003 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 125.049 1.339 . . . . 0.0 110.906 -178.046 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? . . . . . 0 C--O 1.237 0.439 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -81.23 138.17 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 124.523 1.129 . . . . 0.0 108.213 -178.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -106.6 133.32 51.46 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -102.55 161.12 13.97 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -66.31 -32.89 74.56 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 64.93 137.85 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 128.627 2.771 . . . . 0.0 112.851 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.34 28.83 44.64 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 t -139.97 178.35 7.32 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.106 2.162 . . . . 0.0 110.923 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.59 -169.49 0.7 Allowed 'General case' 0 C--O 1.246 0.89 1 C-N-CA 132.02 4.128 . . . . 0.0 107.867 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.9 p -80.61 118.84 22.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 116.956 -1.897 . . . . 0.0 108.682 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -169.13 144.95 3.31 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 130.677 3.591 . . . . 0.0 105.676 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.4 p90 -165.49 177.86 7.15 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.555 1.142 . . . . 0.0 108.926 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.9 mt -133.86 125.76 49.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -139.06 140.74 38.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.371 1.468 . . . . 0.0 108.564 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t0 48.52 40.88 16.11 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.243 2.217 . . . . 0.0 113.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.9 m120 67.77 22.96 8.7 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 127.797 2.439 . . . . 0.0 114.042 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 mtpp -130.55 152.8 49.53 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.166 0.986 . . . . 0.0 109.185 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.2 t -79.19 143.39 35.44 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.3 m-85 -147.19 161.08 41.64 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 122.727 0.411 . . . . 0.0 111.248 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.462 ' CE2' HG22 ' A' ' 29' ' ' THR . 47.0 p90 -148.7 159.6 43.96 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.583 0.753 . . . . 0.0 109.453 178.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.0 t -92.49 127.79 44.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.462 HG22 ' CE2' ' A' ' 27' ' ' PHE . 1.1 p -99.47 171.98 7.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.004 0.906 . . . . 0.0 110.91 -178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -76.36 -5.69 48.29 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 127.11 2.164 . . . . 0.0 113.1 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -81.46 104.14 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 124.327 1.051 . . . . 0.0 109.614 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -92.03 140.85 29.24 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -117.13 135.47 23.1 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.83 152.6 68.97 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.097 2.531 . . . . 0.0 111.205 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.37 -26.08 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 122.008 -0.432 . . . . 0.0 110.992 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -66.58 -19.5 65.79 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.59 -0.694 . . . . 0.0 112.044 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -96.55 -14.77 22.02 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.066 1.746 . . . . 0.0 111.028 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.3 t -67.5 139.11 21.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.404 HD22 ' ND2' ' A' ' 40' ' ' ASN . 12.2 t30 -88.06 -54.18 4.35 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.151 1.38 . . . . 0.0 110.807 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.404 ' ND2' HD22 ' A' ' 39' ' ' ASN . 0.0 OUTLIER -171.06 169.33 6.61 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.314 1.446 . . . . 0.0 110.892 -179.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.6 p -65.55 161.09 20.96 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.274 1.83 . . . . 0.0 109.466 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -130.62 -56.05 1.07 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.573 -1.203 . . . . 0.0 112.306 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.9 t -148.79 143.73 18.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 119.194 0.906 . . . . 0.0 111.444 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -121.96 109.28 14.41 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.967 1.307 . . . . 0.0 109.82 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -136.81 156.69 48.17 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 130.853 3.661 . . . . 0.0 105.723 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -117.7 114.94 24.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.576 1.08 . . . . 0.0 109.941 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.576 ' HE3' HD23 ' A' ' 49' ' ' LEU . 9.3 tptm -147.02 122.58 10.44 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.073 0.949 . . . . 0.0 109.556 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.416 HD12 HG22 ' A' ' 70' ' ' VAL . 9.7 tt -135.76 141.34 44.81 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.943 2.097 . . . . 0.0 107.578 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.61 HD22 HD11 ' A' ' 58' ' ' LEU . 0.8 OUTLIER -151.61 171.31 17.82 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.682 1.193 . . . . 0.0 109.725 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.2 mt -123.98 130.52 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.7 t -125.88 151.92 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.511 1.525 . . . . 0.0 107.238 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -101.52 126.58 48.35 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.2 1.364 . . . . 0.0 108.321 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.8 mtp -64.91 -21.19 66.77 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.793 1.633 . . . . 0.0 112.323 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -54.56 38.96 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 119.052 0.842 . . . . 0.0 112.795 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.2 m -112.62 -2.51 14.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.755 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 59.5 34.61 22.57 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.468 1.907 . . . . 0.0 111.162 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -111.82 156.75 21.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.494 0.717 . . . . 0.0 110.464 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.61 HD11 HD22 ' A' ' 49' ' ' LEU . 3.6 mm? -67.53 142.45 56.54 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.087 . . . . 0.0 110.12 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.3 mt -120.7 175.72 5.88 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.142 1.777 . . . . 0.0 110.787 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.2 m -116.2 3.67 13.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.586 2.355 . . . . 0.0 111.019 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.1 t -160.16 160.79 33.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 p -97.68 121.18 39.28 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.346 1.459 . . . . 0.0 107.679 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.65 168.29 15.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.382 1.073 . . . . 0.0 110.607 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -50.74 -41.84 56.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -77.74 -1.68 32.47 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.769 0.713 . . . . 0.0 111.535 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.6 t -112.77 163.5 14.51 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.804 1.642 . . . . 0.0 110.831 -178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.32 134.26 17.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 129.315 3.046 . . . . 0.0 104.935 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.49 144.23 28.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -127.24 145.44 50.78 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.416 HG22 HD12 ' A' ' 48' ' ' LEU . 7.7 t -120.43 104.14 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 103.141 -2.911 . . . . 0.0 103.141 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -98.23 93.76 6.41 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -169.17 -167.48 0.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 49.89 67.98 0.82 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.836 1.654 . . . . 0.0 113.123 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.6 mt -71.47 144.42 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.353 1.461 . . . . 0.0 111.952 -178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -137.36 169.46 17.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.373 2.669 . . . . 0.0 110.102 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -121.48 154.65 36.32 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 126.414 1.886 . . . . 0.0 108.136 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.88 166.97 10.51 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 125.753 1.621 . . . . 0.0 109.978 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m -62.17 -27.56 69.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.415 0.286 . . . . 0.0 111.054 178.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -84.35 15.42 3.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.834 1.254 . . . . 0.0 110.471 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.9 mmmm 66.57 4.44 3.34 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.9 1.68 . . . . 0.0 111.056 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.01 164.65 26.38 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 178.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.0 mt -116.66 155.22 29.19 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 109.145 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.3 p -147.81 166.75 26.63 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.89 0.476 . . . . 0.0 110.039 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 50.5 ttm -130.86 141.95 50.35 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 126.077 1.751 . . . . 0.0 110.249 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.27 121.82 5.66 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 125.49 1.519 . . . . 0.0 110.483 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.2 mt -140.77 116.72 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 104.451 -2.426 . . . . 0.0 104.451 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 53.44 51.13 15.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.81 0.844 . . . . 0.0 110.628 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 62.4 -2.89 0.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.389 2.676 . . . . 0.0 115.769 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -101.98 138.35 39.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.368 1.867 . . . . 0.0 108.581 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -96.21 116.48 29.07 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -105.8 127.86 53.36 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.873 1.669 . . . . 0.0 109.33 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.415 ' HB2' HD13 ' A' ' 33' ' ' ILE . 23.3 ttpt -63.41 150.73 42.89 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.994 0.918 . . . . 0.0 110.152 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -119.3 133.68 65.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 179.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -126.07 161.24 52.82 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.388 1.075 . . . . 0.0 110.03 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.45 153.83 65.46 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.864 2.376 . . . . 0.0 109.611 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.2 pm0 -56.56 -22.83 36.1 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.491 0.716 . . . . 0.0 110.819 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.6 m -57.17 -22.65 41.93 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.903 1.681 . . . . 0.0 111.19 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -76.31 1.1 17.09 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.731 1.212 . . . . 0.0 113.2 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.75 143.21 37.54 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 120.968 -1.083 . . . . 0.0 110.61 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.82 -42.44 1.9 Allowed Glycine 0 CA--C 1.522 0.508 0 C-N-CA 125.806 1.669 . . . . 0.0 110.737 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.65 -16.1 13.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.587 1.193 . . . . 0.0 111.771 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.51 143.47 41.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -135.15 169.61 17.18 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.465 1.106 . . . . 0.0 108.929 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.9 158.37 30.83 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.509 0.671 . . . . 0.0 109.602 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.19 164.12 13.83 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.489 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -113.24 135.78 53.45 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.362 1.065 . . . . 0.0 110.032 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.539 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.7 OUTLIER -65.43 -10.64 35.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.971 1.709 . . . . 0.0 111.386 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -60.29 -25.36 65.68 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.696 1.599 . . . . 0.0 111.47 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -72.79 -0.23 12.77 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.397 -177.914 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? . . . . . 0 C--O 1.235 0.301 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.61 153.49 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -120.69 122.02 39.54 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 102.865 -3.013 . . . . 0.0 102.865 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -105.71 -178.03 3.53 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 120.822 1.646 . . . . 0.0 112.633 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -56.95 -33.95 67.53 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 129.153 2.981 . . . . 0.0 115.15 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 38.34 70.71 0.19 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 127.911 2.484 . . . . 0.0 114.28 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.0 7.97 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 113.6 -1.636 . . . . 0.0 111.981 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 179.26 6.57 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.021 0.928 . . . . 0.0 110.533 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.1 -169.62 0.64 Allowed 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.9 p -78.29 122.07 25.25 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 119.467 -2.021 . . . . 0.0 110.559 -174.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -166.27 147.03 6.4 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 130.479 3.512 . . . . 0.0 105.938 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 36.5 p90 -167.0 172.76 9.88 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 125.439 1.495 . . . . 0.0 107.917 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.2 mt -134.95 121.94 35.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 O-C-N 120.537 -1.352 . . . . 0.0 108.669 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -132.62 137.36 46.99 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.136 1.374 . . . . 0.0 107.83 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.45 34.13 17.55 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.149 1.38 . . . . 0.0 112.915 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 71.52 9.79 6.44 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.131 2.572 . . . . 0.0 113.277 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -111.04 139.17 46.63 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 134.04 38.71 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.5 m-85 -137.28 166.63 23.33 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 125.037 1.335 . . . . 0.0 110.354 -178.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -149.21 170.47 18.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.3 t -105.04 123.42 59.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 p -92.81 169.51 10.41 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.91 1.684 . . . . 0.0 110.503 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -79.2 -10.16 59.75 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.258 1.423 . . . . 0.0 111.978 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.74 100.15 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.826 0.851 . . . . 0.0 109.039 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -86.49 147.21 26.08 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.76 137.43 24.31 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.99 1.316 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.83 147.47 75.04 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.729 2.286 . . . . 0.0 109.326 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -55.78 -32.96 63.93 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.387 0.675 . . . . 0.0 112.728 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -64.9 -21.88 66.89 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.954 0.901 . . . . 0.0 112.075 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -90.98 -19.76 22.87 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.489 -0.757 . . . . 0.0 110.432 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.9 t -70.3 129.55 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.513 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -83.12 -61.58 1.82 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.74 0.816 . . . . 0.0 110.529 -179.322 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.12 169.67 21.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.483 0.583 . . . . 0.0 110.763 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.7 p -64.77 153.03 41.11 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.026 0.93 . . . . 0.0 109.327 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.589 ' HE3' HD12 ' A' ' 82' ' ' LEU . 8.6 ttmm -124.66 -50.36 1.74 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.2 t -149.71 140.69 16.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -106.84 121.08 43.68 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.802 1.241 . . . . 0.0 108.073 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -150.3 159.03 44.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.423 3.489 . . . . 0.0 105.85 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.45 107.39 5.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -138.36 129.8 27.6 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.5 tt -137.84 138.41 39.1 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.17 169.3 18.14 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 125.284 1.433 . . . . 0.0 107.343 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 65.7 mt -124.43 131.21 73.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.3 t -122.25 127.62 75.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 124.865 1.266 . . . . 0.0 110.837 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HB2' HD21 ' A' ' 59' ' ' LEU . 38.2 t70 -74.63 100.16 3.86 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 126.794 2.038 . . . . 0.0 107.482 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 73.1 mtp -55.22 -29.14 57.38 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.488 0.585 . . . . 0.0 112.157 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.64 84.67 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 125.03 1.332 . . . . 0.0 113.556 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -121.85 -4.63 9.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.955 1.252 . . . . 0.0 112.216 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 63.26 34.57 13.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.769 2.028 . . . . 0.0 110.291 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -119.83 157.14 29.28 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.095 0.958 . . . . 0.0 110.937 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.44 151.41 44.02 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.022 0.529 . . . . 0.0 111.648 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 52' ' ' ASP . 46.4 mt -134.84 174.49 10.53 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.726 2.01 . . . . 0.0 109.07 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 21.0 p -117.16 -5.31 11.37 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.707 1.603 . . . . 0.0 112.705 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 m -144.88 129.97 18.5 Favored 'General case' 0 CA--C 1.521 -0.166 0 O-C-N 120.001 -1.687 . . . . 0.0 107.7 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.59 122.48 23.99 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -127.77 170.7 12.46 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.937 2.095 . . . . 0.0 108.349 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -58.63 -13.13 5.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 -177.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -104.9 8.64 34.71 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.827 1.194 . . . . 0.0 109.325 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.21 162.03 27.12 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.441 1.097 . . . . 0.0 112.793 -177.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -132.31 160.04 42.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 126.363 1.865 . . . . 0.0 108.251 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 t -105.72 142.7 34.99 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -134.24 120.46 20.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.49 103.22 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -91.85 93.01 8.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.05 -169.22 2.12 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.12 67.4 0.84 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.848 2.059 . . . . 0.0 113.183 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.8 mt -73.59 146.81 9.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 O-C-N 121.057 -1.027 . . . . 0.0 111.064 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -142.75 169.47 17.51 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 126.674 1.989 . . . . 0.0 111.191 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -114.53 158.11 22.09 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 127.307 2.243 . . . . 0.0 106.103 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.58 167.41 14.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.597 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.5 t -62.99 -23.5 67.47 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 122.979 0.512 . . . . 0.0 111.481 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -86.7 6.63 30.33 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 120.805 -1.185 . . . . 0.0 109.47 179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm 68.89 1.18 3.02 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.976 2.51 . . . . 0.0 111.056 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.5 m -73.81 154.97 39.3 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.589 HD12 ' HE3' ' A' ' 42' ' ' LYS . 1.2 mm? -108.71 152.88 24.23 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.161 0.984 . . . . 0.0 110.341 -178.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.6 p -141.2 177.38 8.12 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.088 0.47 . . . . 0.0 111.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.9 ttm -136.69 138.23 40.83 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 126.234 1.814 . . . . 0.0 109.398 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.65 118.44 4.67 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 107.522 -2.231 . . . . 0.0 107.522 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -135.03 123.35 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 49.95 45.13 25.38 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 123.789 0.681 . . . . 0.0 109.878 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 63.15 18.99 11.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.528 1.931 . . . . 0.0 114.836 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -124.46 144.78 49.89 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.173 0.989 . . . . 0.0 109.844 178.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -94.15 115.99 28.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.735 0.698 . . . . 0.0 112.047 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.81 124.07 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.205 1.402 . . . . 0.0 109.764 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -62.28 147.94 46.49 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.54 1.136 . . . . 0.0 111.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -115.95 134.33 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 123.887 0.875 . . . . 0.0 109.238 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -127.6 158.46 69.91 Favored Pre-proline 0 C--O 1.235 0.313 0 C-N-CA 124.671 1.189 . . . . 0.0 109.983 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -75.39 154.3 40.6 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.718 2.279 . . . . 0.0 110.811 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.94 -6.48 12.62 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.957 -0.465 . . . . 0.0 111.811 178.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.3 p -72.86 -14.55 61.52 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.488 -1.382 . . . . 0.0 110.451 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.21 -4.92 58.02 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 142.51 34.08 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.01 0.924 . . . . 0.0 111.208 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.53 -15.24 19.99 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 126.107 1.813 . . . . 0.0 111.079 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.43 -12.68 0.8 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.473 1.509 . . . . 0.0 111.95 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.1 150.24 31.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -141.57 162.74 34.74 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.103 1.361 . . . . 0.0 108.368 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.31 167.02 1.47 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.572 0.701 . . . . 0.0 112.884 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.16 161.25 13.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.693 0.759 . . . . 0.0 112.559 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.0 mmm-85 -109.24 117.26 33.65 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -6.02 16.77 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.369 0.418 . . . . 0.0 111.795 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -59.52 -23.49 62.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 110.491 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -69.14 -12.09 61.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.728 0.811 . . . . 0.0 112.554 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.943 1.697 . . . . 0.0 107.746 -178.526 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.468 0.442 0 CA-C-O 121.414 0.626 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.2 t -95.06 133.17 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 125.627 1.571 . . . . 0.0 107.997 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -95.52 122.16 37.97 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -89.38 161.56 16.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -68.98 -33.78 74.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.827 1.651 . . . . 0.0 111.602 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 46.68 99.18 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 127.291 2.236 . . . . 0.0 114.802 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.74 20.75 53.12 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.039 -1.437 . . . . 0.0 112.395 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.91 179.53 6.12 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.75 1.62 . . . . 0.0 111.661 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -169.94 0.98 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.056 2.142 . . . . 0.0 107.361 177.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.0 p -80.63 120.4 24.52 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 124.586 2.136 . . . . 0.0 111.681 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -168.58 153.54 6.24 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 130.941 3.696 . . . . 0.0 106.108 177.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -168.52 173.79 7.26 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.0 mt -132.92 120.19 40.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -130.58 138.13 50.0 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t0 55.57 35.22 24.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.601 1.56 . . . . 0.0 112.071 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 65.1 15.65 10.12 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 127.345 2.258 . . . . 0.0 112.842 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -118.66 142.1 47.98 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.9 m -75.63 142.83 42.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -139.8 162.57 34.82 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.076 1.751 . . . . 0.0 109.585 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -148.86 166.81 27.42 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.675 1.19 . . . . 0.0 109.129 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.1 t -97.33 128.64 48.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 C-N-CA 123.04 0.536 . . . . 0.0 109.599 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 HD23 ' A' ' 94' ' ' LEU . 27.0 p -97.0 170.25 9.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.129 0.972 . . . . 0.0 111.112 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -77.82 -14.43 59.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.962 1.305 . . . . 0.0 111.982 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -69.01 101.21 1.35 Allowed 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 125.264 1.426 . . . . 0.0 110.614 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.404 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.0 tt0 -90.14 141.6 28.53 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.421 HG23 ' HD2' ' A' ' 34' ' ' PRO . 1.7 mp -118.14 143.98 33.95 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.482 1.113 . . . . 0.0 108.389 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 33' ' ' ILE . 74.5 Cg_endo -71.78 154.93 58.9 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.304 3.336 . . . . 0.0 113.383 -178.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -58.22 -33.34 69.21 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.124 0.97 . . . . 0.0 111.9 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -62.52 -23.16 66.8 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.748 0.819 . . . . 0.0 111.539 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -90.49 -22.84 21.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.184 0.594 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.98 119.3 6.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -77.5 -59.96 2.56 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.082 0.953 . . . . 0.0 110.223 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.37 20.11 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.511 0.725 . . . . 0.0 110.533 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.406 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -65.38 165.33 12.04 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.031 0.92 . . . . 0.0 108.724 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.89 -53.37 1.42 Allowed 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 120.785 -1.197 . . . . 0.0 108.631 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 t -140.86 145.4 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm -124.81 92.95 3.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.665 1.186 . . . . 0.0 108.566 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -137.32 155.31 49.59 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 128.962 2.905 . . . . 0.0 106.851 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -120.96 130.49 53.86 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.856 0.862 . . . . 0.0 111.844 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -148.81 126.85 11.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.403 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.4 tt -131.25 145.06 51.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.179 2.592 . . . . 0.0 110.256 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.467 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -152.3 171.04 18.6 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.588 1.955 . . . . 0.0 109.506 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.4 mt -128.34 127.77 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.187 1.395 . . . . 0.0 108.096 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 t -122.68 148.8 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.43 1.492 . . . . 0.0 109.131 -179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' A' ' 59' ' ' LEU . 4.8 t0 -92.83 125.98 37.7 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.185 1.394 . . . . 0.0 107.468 178.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 75.6 mtp -67.87 -26.23 65.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.869 1.213 . . . . 0.0 110.605 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -63.04 -41.55 99.52 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.4 m -121.99 -1.61 9.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.588 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 60.98 27.28 17.17 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.953 1.301 . . . . 0.0 109.835 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 9.3 mmpt? -103.45 154.03 19.88 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.391 1.076 . . . . 0.0 110.84 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.403 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -69.65 155.11 41.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 52' ' ' ASP . 89.6 mt -131.32 175.12 9.4 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.164 1.386 . . . . 0.0 109.726 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -113.94 -4.81 13.21 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.315 1.446 . . . . 0.0 110.68 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.6 p -152.41 154.06 34.82 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 120.393 1.452 . . . . 0.0 108.98 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -84.59 124.44 31.44 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -129.07 165.58 20.94 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.662 1.585 . . . . 0.0 108.392 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -56.08 -43.72 78.29 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.429 -0.794 . . . . 0.0 112.359 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -74.61 5.74 4.53 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.6 t -113.58 166.25 11.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.324 1.45 . . . . 0.0 111.034 -179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.8 t -143.48 123.8 9.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 126.704 2.002 . . . . 0.0 106.358 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.8 t -80.51 144.32 32.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.39 147.26 52.55 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.78 103.5 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -99.05 91.76 5.17 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -166.97 0.96 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -176.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 55.79 67.09 1.06 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.676 0.391 . . . . 0.0 111.716 176.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mt -77.36 138.16 20.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.569 0.747 . . . . 0.0 110.632 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.406 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.7 m-85 -137.45 169.65 17.42 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 127.175 2.19 . . . . 0.0 109.808 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -118.17 156.76 28.17 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.125 1.77 . . . . 0.0 108.283 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.01 171.05 7.77 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 126.031 1.732 . . . . 0.0 112.375 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.2 p -57.07 -37.0 71.22 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 127.309 2.244 . . . . 0.0 112.176 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -87.72 16.13 6.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.532 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 69.38 -1.34 2.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 126.821 2.049 . . . . 0.0 111.134 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.67 164.89 20.55 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.86 0.755 . . . . 0.0 109.614 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.09 144.9 41.84 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.829 1.252 . . . . 0.0 109.415 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.37 168.25 20.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.869 0.868 . . . . 0.0 109.52 178.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 38.4 ttm -134.07 143.24 47.91 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.948 1.699 . . . . 0.0 109.749 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.85 124.43 6.85 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 125.217 1.389 . . . . 0.0 110.43 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 57.0 mt -143.13 120.92 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 53.8 44.81 29.03 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.293 1.044 . . . . 0.0 109.607 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.13 14.6 3.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.706 2.802 . . . . 0.0 114.327 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -116.86 147.48 42.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.722 1.609 . . . . 0.0 107.198 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -98.9 116.52 31.33 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.931 0.892 . . . . 0.0 112.527 -177.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -108.49 128.26 54.65 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.683 1.593 . . . . 0.0 109.781 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.697 ' HE2' HD21 ' A' ' 94' ' ' LEU . 7.3 ttpt -65.75 151.0 47.6 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.413 -0.804 . . . . 0.0 110.164 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.56 134.29 63.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.697 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.3 mm? -122.32 157.91 57.29 Favored Pre-proline 0 C--O 1.233 0.237 0 C-N-CA 124.023 0.929 . . . . 0.0 110.119 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.59 155.71 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.377 2.052 . . . . 0.0 110.346 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.64 -9.2 25.08 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.375 -0.828 . . . . 0.0 110.557 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 m -70.82 -8.1 50.1 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.279 2.232 . . . . 0.0 110.72 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . 0.257 0.0 OUTLIER -114.49 3.15 14.83 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -51.28 161.09 0.47 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.866 1.266 . . . . 0.0 111.784 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.33 -42.54 3.11 Favored Glycine 0 CA--C 1.522 0.519 0 O-C-N 120.926 -1.109 . . . . 0.0 111.351 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.96 53.18 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.124 1.462 . . . . 0.0 108.983 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.5 147.94 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 C-N-CA 126.443 1.897 . . . . 0.0 108.622 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -114.15 167.44 10.68 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.027 1.331 . . . . 0.0 108.508 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.88 166.08 20.24 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.851 0.834 . . . . 0.0 109.317 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -61.41 157.95 15.71 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.351 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.473 ' N ' HD12 ' A' ' 105' ' ' LEU . 41.0 ptt180 -110.45 139.46 45.65 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.005 0.922 . . . . 0.0 113.27 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.2 -28.15 69.18 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.976 1.71 . . . . 0.0 110.105 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -53.22 -30.31 37.23 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.006 1.722 . . . . 0.0 113.792 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -70.08 -11.29 60.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.432 0.693 . . . . 0.0 109.661 -177.22 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.674 -0.679 . . . . 0.0 109.735 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.7 t -71.19 145.49 12.52 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 CA-C-N 119.193 0.906 . . . . 0.0 109.224 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 -103.14 97.35 7.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.5 145.0 41.72 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.24 -25.44 63.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.701 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 66.78 142.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.671 2.389 . . . . 0.0 112.901 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.99 28.03 15.89 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.249 0.928 . . . . 0.0 112.928 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -137.28 177.89 7.51 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 125.305 1.442 . . . . 0.0 110.931 -178.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -74.79 -168.9 0.79 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 127.173 2.189 . . . . 0.0 107.701 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.251 7.7 p -79.61 120.21 23.63 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 120.43 -1.419 . . . . 0.0 107.248 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -168.18 148.21 4.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 131.649 3.98 . . . . 0.0 104.712 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -172.68 165.57 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 mm -117.87 135.9 56.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 122.027 0.918 . . . . 0.0 108.642 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -149.09 142.74 25.48 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.221 -1.809 . . . . 0.0 108.962 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t0 51.85 33.61 11.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.871 1.268 . . . . 0.0 110.863 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 55.57 29.12 12.9 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 127.573 2.349 . . . . 0.0 112.463 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -124.6 144.01 50.4 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 m -81.88 114.43 20.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -117.76 165.7 13.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.722 2.009 . . . . 0.0 111.879 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -150.33 173.89 13.48 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.175 1.39 . . . . 0.0 109.576 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.49 128.55 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 p -90.02 163.88 14.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.943 1.297 . . . . 0.0 113.584 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -75.74 -16.78 60.09 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.221 1.809 . . . . 0.0 112.737 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -75.18 136.94 41.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.602 1.561 . . . . 0.0 106.893 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.515 ' C ' HD12 ' A' ' 33' ' ' ILE . 42.3 tt0 -118.9 147.32 44.12 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.708 1.603 . . . . 0.0 111.095 -178.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.515 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.5 mp -118.46 136.88 24.24 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.605 1.562 . . . . 0.0 107.432 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.02 156.87 26.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 124.615 3.543 . . . . 0.0 112.136 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -57.95 -28.47 64.35 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.811 0.844 . . . . 0.0 111.737 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -67.13 -14.42 62.89 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.07 -1.019 . . . . 0.0 112.119 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -104.08 -8.31 19.6 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.609 1.164 . . . . 0.0 110.889 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.65 132.38 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.703 1.601 . . . . 0.0 108.668 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -83.63 -56.09 3.92 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.572 1.149 . . . . 0.0 110.445 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.08 170.09 9.04 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.713 1.605 . . . . 0.0 109.412 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.8 p -68.97 174.03 4.86 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.7 tttp -138.92 -39.02 0.5 Allowed 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.179 -0.951 . . . . 0.0 112.407 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -149.34 117.55 0.93 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.714 0.806 . . . . 0.0 109.043 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 124.22 33.48 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 104.322 -2.473 . . . . 0.0 104.322 176.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.69 157.18 42.66 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 128.417 2.687 . . . . 0.0 105.312 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -140.59 109.7 6.14 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.413 1.085 . . . . 0.0 110.332 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -144.18 139.72 28.92 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -137.28 144.74 42.84 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 127.696 2.398 . . . . 0.0 108.256 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -154.47 169.55 23.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 61.9 mt -131.07 134.02 62.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 t -122.88 143.11 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.468 1.107 . . . . 0.0 108.282 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.08 123.86 28.74 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 106.388 -1.708 . . . . 0.0 106.388 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtp -68.24 -21.85 64.81 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 120.287 1.403 . . . . 0.0 114.018 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -74.27 -53.57 9.48 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.856 0.753 . . . . 0.0 110.364 -179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.8 m -91.92 -15.87 27.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.54 30.76 19.99 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 126.545 1.938 . . . . 0.0 111.798 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -115.59 161.09 19.13 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.633 1.173 . . . . 0.0 109.257 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.34 149.45 44.39 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.193 0.52 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 mt -129.19 173.05 10.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.33 1.852 . . . . 0.0 107.786 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 t -118.66 12.72 13.16 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.255 1.022 . . . . 0.0 111.512 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.5 p -159.07 157.75 31.7 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.827 1.194 . . . . 0.0 109.28 -179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 t -89.7 119.91 30.51 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.948 0.899 . . . . 0.0 110.098 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -130.72 160.12 35.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.314 1.045 . . . . 0.0 109.473 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -51.8 -20.72 2.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -104.32 5.71 34.73 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.807 1.639 . . . . 0.0 111.161 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 21.1 m -115.55 165.74 12.67 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 124.95 1.3 . . . . 0.0 111.203 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.8 t -140.57 144.5 27.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 124.515 1.126 . . . . 0.0 108.259 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.1 t -87.48 143.37 27.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.761 1.224 . . . . 0.0 108.89 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.0 mt -136.78 122.88 20.34 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.9 t -104.88 103.29 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 103.556 -2.757 . . . . 0.0 103.556 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.02 97.48 10.74 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.94 -172.92 2.2 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.22 68.96 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.939 1.696 . . . . 0.0 114.79 177.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.8 mt -71.03 141.14 17.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.73 1.612 . . . . 0.0 109.223 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -131.44 169.43 16.06 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.171 1.788 . . . . 0.0 109.341 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -114.85 152.79 31.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.207 1.403 . . . . 0.0 107.546 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.09 160.74 14.59 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.947 1.299 . . . . 0.0 109.824 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -65.07 -24.68 67.53 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.238 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -85.7 12.85 8.04 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 126.588 1.955 . . . . 0.0 110.662 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 69.75 -1.82 2.19 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.917 2.087 . . . . 0.0 110.524 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.0 m -70.97 168.69 16.45 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.4 148.8 45.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.909 0.884 . . . . 0.0 111.177 -178.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 21.1 p -141.94 172.06 13.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.151 0.98 . . . . 0.0 111.019 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.4 ttm -133.05 139.71 47.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 126.121 1.768 . . . . 0.0 109.365 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.59 124.3 6.64 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.5 mt -141.98 123.03 12.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 49.27 44.89 23.61 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.573 1.149 . . . . 0.0 110.871 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.6 t0 67.11 4.27 3.54 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.961 2.905 . . . . 0.0 116.142 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -111.81 145.89 38.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.903 1.281 . . . . 0.0 108.907 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -98.86 117.91 34.43 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 123.034 0.534 . . . . 0.0 111.656 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -105.95 132.15 52.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.685 1.194 . . . . 0.0 107.808 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HE2' HD21 ' A' ' 94' ' ' LEU . 1.4 ttpm? -72.1 158.54 35.75 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 118.596 -1.242 . . . . 0.0 110.336 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.63 133.56 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.625 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.5 mm? -127.04 163.51 41.18 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 125.991 1.716 . . . . 0.0 110.736 -177.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.76 143.3 26.6 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.296 1.997 . . . . 0.0 107.859 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -12.64 20.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.3 m -65.77 -13.81 60.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -76.1 -1.24 25.11 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.362 1.065 . . . . 0.0 112.382 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -50.46 149.77 2.96 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.506 1.122 . . . . 0.0 109.273 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.62 -42.33 2.91 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.45 -39.56 13.28 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.568 0.747 . . . . 0.0 108.986 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -130.44 170.79 18.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 125.798 1.639 . . . . 0.0 109.6 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -145.25 166.34 25.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.469 2.308 . . . . 0.0 108.186 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.42 174.24 5.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.445 0.641 . . . . 0.0 110.792 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.292 0.4 OUTLIER -68.99 176.17 3.3 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.134 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ptp85 -129.92 141.47 50.78 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 125.157 1.383 . . . . 0.0 112.229 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.0 mp -71.63 -17.95 62.23 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.248 0.619 . . . . 0.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -57.8 -26.53 62.08 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.082 1.753 . . . . 0.0 113.484 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -76.63 -9.43 58.66 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.772 0.829 . . . . 0.0 110.446 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 tptt . . . . . 0 N--CA 1.463 0.202 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.2 t -119.78 139.92 45.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 120.707 1.594 . . . . 0.0 108.798 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -107.18 118.41 36.65 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -84.66 175.42 9.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -80.84 -34.13 34.04 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 127.417 2.287 . . . . 0.0 110.459 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 54.13 127.64 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 128.465 2.706 . . . . 0.0 115.042 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.98 25.23 61.57 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.363 -0.836 . . . . 0.0 112.577 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 m -140.49 -179.62 6.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 126.95 2.1 . . . . 0.0 110.785 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -73.69 -171.06 0.96 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.491 1.516 . . . . 0.0 109.005 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.7 p -80.53 120.76 24.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 119.511 -1.993 . . . . 0.0 111.626 -175.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -167.16 154.9 9.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.44 3.896 . . . . 0.0 105.294 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 49.0 p90 -170.11 173.49 5.88 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.693 1.588 . . . . 0.0 107.437 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.1 mt -131.58 119.01 41.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 O-C-N 120.529 -1.357 . . . . 0.0 107.496 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -129.38 137.8 51.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.28 34.12 22.13 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.796 1.239 . . . . 0.0 111.438 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.7 m120 62.98 14.99 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.452 2.701 . . . . 0.0 112.931 -178.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -111.62 132.94 54.22 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.8 m -76.32 129.06 36.08 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.0 m-85 -132.84 164.1 27.63 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 126.603 1.961 . . . . 0.0 110.516 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -149.25 159.37 44.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 109.442 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 t -89.72 132.23 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.4 p -102.04 166.3 10.69 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.732 1.213 . . . . 0.0 110.091 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.1 -7.69 55.32 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.342 1.057 . . . . 0.0 112.122 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -71.28 114.22 9.12 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -101.99 144.11 31.01 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.07 140.01 23.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.863 2.065 . . . . 0.0 108.403 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.77 156.15 39.56 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 123.016 2.477 . . . . 0.0 109.89 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.53 -29.47 69.14 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.12 -19.5 65.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.074 0.55 . . . . 0.0 111.936 179.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -93.17 -13.57 28.24 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.592 0.757 . . . . 0.0 110.28 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 65.7 t -75.2 123.5 31.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.423 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.3 OUTLIER -80.24 -61.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.441 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.44 163.99 38.79 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.253 -0.904 . . . . 0.0 112.351 -178.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 m -65.5 137.26 57.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.601 1.56 . . . . 0.0 107.152 178.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' OE2' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -112.29 -53.87 2.67 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.883 -177.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.1 t -141.01 134.39 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 119.814 1.188 . . . . 0.0 112.547 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.3 mtpt -103.53 110.21 22.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.05 156.75 44.1 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.445 2.698 . . . . 0.0 106.493 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -128.31 113.18 15.3 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.844 0.857 . . . . 0.0 110.723 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.88 134.41 18.63 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.954 0.797 . . . . 0.0 110.468 178.263 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.478 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 9.0 tt -138.32 145.04 40.69 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.85 1.66 . . . . 0.0 108.283 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -148.75 170.39 18.32 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.099 1.36 . . . . 0.0 107.402 179.266 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.431 ' O ' HD13 ' A' ' 58' ' ' LEU . 50.9 mt -129.48 132.21 66.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.3 t -126.72 139.74 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.649 1.18 . . . . 0.0 109.458 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -85.99 128.36 34.83 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.309 -0.87 . . . . 0.0 109.406 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 46.9 mtp -68.64 -19.44 64.42 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttm -77.16 -46.85 22.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.519 1.509 . . . . 0.0 111.952 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.0 p -105.2 -6.06 20.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 63.88 18.81 11.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.695 1.198 . . . . 0.0 110.378 -179.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -101.72 159.91 14.91 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.342 0.974 . . . . 0.0 111.739 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.8 mm? -73.2 145.76 46.03 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.415 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 mt -126.6 166.32 17.53 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.893 2.077 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.83 -33.55 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.612 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.5 m -130.02 150.01 51.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.461 1.104 . . . . 0.0 109.551 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.92 111.09 17.79 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.495 0.718 . . . . 0.0 110.506 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -101.8 168.69 9.28 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 177.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -58.11 -32.66 68.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -78.53 -3.05 41.73 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.071 0.948 . . . . 0.0 110.445 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.4 t -114.58 161.66 17.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.393 1.477 . . . . 0.0 113.219 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.3 t -133.88 146.46 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 126.125 1.77 . . . . 0.0 108.431 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.29 144.19 29.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.966 1.306 . . . . 0.0 109.554 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.7 mt -135.37 122.53 21.53 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.865 -1.147 . . . . 0.0 108.162 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.443 HG22 HD12 ' A' ' 48' ' ' LEU . 3.5 t -106.71 103.41 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -99.36 96.64 7.85 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.124 -1.806 . . . . 0.0 106.124 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.22 -168.91 0.78 Allowed 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 50.06 68.31 0.77 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.88 1.272 . . . . 0.0 112.912 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.74 145.33 11.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.638 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -135.87 169.01 18.26 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.926 2.09 . . . . 0.0 109.064 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.424 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 tt0 -119.16 149.66 41.35 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.482 1.513 . . . . 0.0 107.071 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.56 166.58 10.64 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.593 1.557 . . . . 0.0 110.255 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.2 p -61.2 -29.95 70.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.911 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -101.58 29.47 4.85 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.995 1.718 . . . . 0.0 112.885 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 65.76 -0.82 1.19 Allowed 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.631 1.972 . . . . 0.0 114.055 178.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -67.15 158.89 30.12 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.0 mt -115.62 144.43 43.91 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -138.76 164.88 28.44 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.8 ttm -127.7 137.35 52.45 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.317 1.847 . . . . 0.0 109.524 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.44 117.94 4.52 Favored Glycine 0 CA--C 1.521 0.438 0 C-N-CA 124.71 1.148 . . . . 0.0 110.393 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.8 mt -134.83 118.79 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 125.505 1.522 . . . . 0.0 107.101 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 49.94 47.21 23.56 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.481 1.113 . . . . 0.0 109.754 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 65.18 9.38 5.53 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.165 2.186 . . . . 0.0 114.733 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -115.48 136.95 52.56 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.164 1.386 . . . . 0.0 108.737 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -92.64 117.35 29.88 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.97 -0.456 . . . . 0.0 111.156 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 132.17 52.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.135 -0.978 . . . . 0.0 108.778 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 147.54 51.66 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -115.62 132.62 64.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -124.32 157.38 64.86 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 124.824 1.25 . . . . 0.0 108.775 -178.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.9 154.39 67.24 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.659 2.239 . . . . 0.0 109.685 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -61.04 -15.19 29.51 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.808 0.337 . . . . 0.0 111.631 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.3 p -80.05 -7.73 59.01 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 112.242 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -87.5 -9.58 54.14 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.696 1.598 . . . . 0.0 112.14 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.51 161.83 0.93 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.728 1.211 . . . . 0.0 113.492 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.78 -42.59 2.65 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 107.941 -2.064 . . . . 0.0 107.941 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.18 -27.62 22.92 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.194 0.998 . . . . 0.0 109.396 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.6 p -132.6 166.64 28.69 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.554 1.542 . . . . 0.0 109.882 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -135.94 165.19 26.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.841 2.456 . . . . 0.0 107.363 178.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.98 178.93 0.58 Allowed 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.452 0.644 . . . . 0.0 111.083 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.578 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -70.9 170.23 13.1 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.822 -0.549 . . . . 0.0 109.721 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.578 ' N ' HD12 ' A' ' 105' ' ' LEU . 88.2 mtt180 -126.02 142.18 51.63 Favored 'General case' 0 CA--C 1.52 -0.199 0 O-C-N 121.166 -0.959 . . . . 0.0 110.11 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.4 -17.24 62.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.766 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.68 -18.07 61.74 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -73.15 -13.93 61.27 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.679 0.672 . . . . 0.0 111.784 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 C--O 1.248 0.988 0 C-N-CA 126.369 1.867 . . . . 0.0 110.342 -177.543 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.4 t -116.44 160.27 15.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.039 1.335 . . . . 0.0 108.608 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -128.46 107.69 9.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 102.821 -3.029 . . . . 0.0 102.821 178.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -82.36 166.63 19.29 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -33.98 76.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.158 0.89 . . . . 0.0 110.801 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 55.66 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.606 1.962 . . . . 0.0 113.424 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.51 7.3 51.71 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.819 1.199 . . . . 0.0 112.477 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 m -131.96 179.31 6.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.112 1.765 . . . . 0.0 110.031 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -73.4 -169.74 0.7 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.118 2.167 . . . . 0.0 107.778 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.0 p -80.71 120.31 24.44 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 120.068 -1.645 . . . . 0.0 111.708 -176.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -168.82 147.12 3.99 Favored 'General case' 0 CA--C 1.54 0.573 1 C-N-CA 133.622 4.769 . . . . 0.0 103.224 177.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 44.9 p90 -165.55 169.17 15.74 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 125.311 1.444 . . . . 0.0 107.83 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 20' ' ' ILE . 2.5 mp -123.52 123.02 66.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 O-C-N 120.472 -1.393 . . . . 0.0 108.014 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -133.09 139.2 47.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t70 54.03 33.23 17.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.506 1.522 . . . . 0.0 112.626 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 65.27 24.02 12.19 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.33 1.452 . . . . 0.0 110.486 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -125.13 137.23 54.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.34 144.59 40.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.545 -2.021 . . . . 0.0 105.545 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.6 m-85 -147.99 167.45 24.88 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 127.032 2.133 . . . . 0.0 110.472 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -150.02 171.29 17.08 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.041 0.937 . . . . 0.0 108.761 177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.96 127.53 58.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -94.9 169.19 10.31 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.467 1.107 . . . . 0.0 110.472 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.24 -15.52 58.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.937 1.295 . . . . 0.0 112.817 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 111.96 6.38 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.333 0.653 . . . . 0.0 111.196 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -93.6 140.18 29.91 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.438 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.7 mp -111.67 141.32 24.43 Favored Pre-proline 0 N--CA 1.466 0.358 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.65 151.47 41.45 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.7 1.6 . . . . 0.0 111.194 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -53.97 -29.06 41.3 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.737 1.615 . . . . 0.0 113.263 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -69.89 -29.09 66.2 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 123.289 0.636 . . . . 0.0 110.864 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.91 -15.57 44.03 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.797 0.839 . . . . 0.0 110.666 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.32 138.8 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.539 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -92.8 -61.57 1.56 Allowed 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.266 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.34 166.49 18.61 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.086 0.857 . . . . 0.0 112.245 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.7 m -63.69 138.76 58.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.599 1.16 . . . . 0.0 109.069 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -116.27 -36.34 4.07 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -148.76 142.8 18.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -117.83 102.34 9.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -135.67 157.81 45.94 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 130.419 3.488 . . . . 0.0 106.577 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -141.45 110.45 6.21 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.103 1.361 . . . . 0.0 107.608 179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -141.1 125.53 17.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 tt -125.34 144.39 50.52 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.555 1.542 . . . . 0.0 107.749 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -153.45 169.95 21.92 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 108.948 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.571 ' O ' HD13 ' A' ' 58' ' ' LEU . 31.8 mt -124.29 138.41 53.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 125.613 1.565 . . . . 0.0 106.785 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.6 t -132.77 124.82 51.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.429 1.092 . . . . 0.0 109.977 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -62.19 121.65 13.62 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.664 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.3 mtp -68.2 -18.24 64.53 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 120.71 1.596 . . . . 0.0 112.546 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -84.18 -25.69 29.36 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -122.35 -13.43 8.06 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.273 0.629 . . . . 0.0 111.802 -178.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 63.65 21.27 12.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.605 1.562 . . . . 0.0 109.901 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -105.18 153.15 21.94 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.61 1.164 . . . . 0.0 110.783 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -67.34 148.22 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.958 0.903 . . . . 0.0 110.856 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.5 mt -136.04 177.28 7.96 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.004 1.722 . . . . 0.0 109.392 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.3 p -105.65 -30.36 9.53 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.144 1.377 . . . . 0.0 111.088 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -122.03 151.89 40.35 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.005 0.82 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -89.07 93.28 9.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.243 0.617 . . . . 0.0 109.551 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.69 164.39 18.63 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -57.33 -34.24 68.55 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -80.72 5.39 15.88 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.642 -0.661 . . . . 0.0 111.584 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.4 t -113.42 177.99 4.44 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.201 1.4 . . . . 0.0 111.634 -178.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 p -145.85 159.19 12.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 126.686 1.994 . . . . 0.0 107.419 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.23 143.14 42.46 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.0 mt -131.33 150.87 51.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 t -127.86 102.65 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -86.14 92.03 8.61 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.29 -173.02 3.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 47.3 67.63 0.77 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.874 1.67 . . . . 0.0 112.882 177.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mt -77.9 141.81 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 O-C-N 121.177 -0.952 . . . . 0.0 109.498 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -140.87 166.11 25.69 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.942 1.697 . . . . 0.0 110.039 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -110.9 158.04 19.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.918 2.087 . . . . 0.0 106.952 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.94 168.78 9.77 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.544 1.138 . . . . 0.0 112.27 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -58.06 -35.89 72.0 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.91 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -84.89 21.13 1.65 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.684 1.193 . . . . 0.0 111.785 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.8 mptt 59.1 19.68 7.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.306 1.443 . . . . 0.0 110.721 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.543 ' HB3' ' HE2' ' A' ' 92' ' ' LYS . 63.3 m -79.69 168.68 19.03 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mt -125.46 143.59 50.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.5 p -147.84 168.64 21.68 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.608 0.763 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.0 ttm -135.23 139.54 44.56 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.181 1.792 . . . . 0.0 109.733 -178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.1 6.98 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.9 mt -138.72 124.42 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 52.07 42.53 30.55 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.826 0.822 . . . . 0.0 109.004 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 60.44 20.86 10.52 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.834 2.054 . . . . 0.0 114.105 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 -122.07 137.66 54.73 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.712 1.605 . . . . 0.0 108.477 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -93.27 116.32 28.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -106.52 129.83 54.41 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.536 1.135 . . . . 0.0 110.754 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.543 ' HE2' ' HB3' ' A' ' 81' ' ' SER . 51.1 tttm -64.28 145.36 56.14 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.621 -0.674 . . . . 0.0 109.878 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.52 133.09 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -120.13 156.64 54.6 Favored Pre-proline 0 C--O 1.238 0.468 0 C-N-CA 124.128 0.971 . . . . 0.0 109.342 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.02 141.88 54.61 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 N-CA-C 106.726 -2.067 . . . . 0.0 106.726 179.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -22.1 37.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.673 -0.642 . . . . 0.0 111.668 -179.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 t -66.16 -13.17 59.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.129 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -3.16 43.56 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 120.563 1.529 . . . . 0.0 114.098 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -50.85 162.01 0.31 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.24 1.416 . . . . 0.0 113.794 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.84 -43.65 2.98 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 127.074 2.274 . . . . 0.0 110.969 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.89 -22.54 45.8 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -133.05 159.23 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 C-N-CA 130.78 3.632 . . . . 0.0 106.1 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -135.6 169.42 17.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 123.461 0.704 . . . . 0.0 109.953 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.84 160.29 17.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.71 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.527 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.2 158.6 8.72 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.937 0.875 . . . . 0.0 112.774 -178.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.527 ' N ' HD12 ' A' ' 105' ' ' LEU . 9.4 mtt85 -109.94 119.24 38.7 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 124.744 1.217 . . . . 0.0 108.551 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -9.35 43.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.937 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.62 -22.12 66.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.452 1.101 . . . . 0.0 110.959 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -70.24 -9.04 54.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.646 1.178 . . . . 0.0 113.356 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 125.018 1.327 . . . . 0.0 110.178 -178.078 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.884 0.373 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -154.13 109.63 3.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.888 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.99 109.02 19.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.13 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.46 75.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.845 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -179.18 121.43 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -118.06 139.14 51.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.65 127.82 33.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.1 t -80.52 133.4 29.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -103.23 111.9 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -89.61 149.74 22.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -62.62 -34.97 78.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.845 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 65.27 138.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.89 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.69 25.47 9.17 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.479 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.29 -175.91 4.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.363 . . . . 0.0 110.847 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -165.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.9 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.434 HG21 HD23 ' A' ' 105' ' ' LEU . 22.2 p -75.67 116.75 16.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.142 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -171.54 153.46 3.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.679 ' HZ ' HD12 ' A' ' 93' ' ' ILE . 9.8 p90 -174.9 158.1 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.886 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 84.8 mt -120.27 127.97 75.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -131.18 130.68 43.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.896 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t0 63.74 35.64 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.838 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 63.89 30.4 14.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.872 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -134.28 133.87 41.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 m -64.97 144.16 57.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.876 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 95' ' ' PRO . 5.7 m-85 -154.33 157.22 38.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 29' ' ' THR . 35.1 p90 -149.24 163.5 37.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 86' ' ' ILE . 21.7 t -88.77 127.33 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.164 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.52 HG22 ' CE2' ' A' ' 27' ' ' PHE . 19.1 p -97.78 165.19 12.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.14 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -73.04 -17.41 61.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.853 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.72 126.61 28.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.857 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.433 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.4 tt0 -110.24 140.39 44.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.883 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.433 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -113.13 134.4 21.85 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.59 0.709 . . . . 0.0 111.146 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 147.4 62.32 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.644 2.23 . . . . 0.0 112.388 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -54.89 -31.62 60.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.923 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -62.67 -21.95 66.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -93.41 -20.44 20.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.926 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -70.56 135.78 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.143 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -85.41 -57.34 3.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -171.67 178.33 3.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.894 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.0 p -55.76 161.22 2.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HE2' HD12 ' A' ' 82' ' ' LEU . 12.3 tttm -131.85 -51.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.913 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.5 t -150.57 141.97 16.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.079 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -106.66 114.45 28.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -148.68 156.89 43.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -125.65 107.97 11.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE3' HD23 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -142.2 126.0 17.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.869 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.8 tt -138.08 138.98 39.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.644 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -152.18 169.39 22.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.731 ' O ' HD13 ' A' ' 58' ' ' LEU . 21.4 mt -122.82 135.79 61.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.085 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.735 HG22 HD22 ' A' ' 58' ' ' LEU . 14.1 t -129.52 137.5 56.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.094 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.631 ' OD2' HD11 ' A' ' 59' ' ' LEU . 2.0 t70 -86.12 123.26 31.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.881 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.4 mtp -69.17 -9.95 55.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.06 -54.2 28.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.955 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -122.15 10.03 9.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.887 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 55.94 35.94 26.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -111.48 158.2 19.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.735 HD22 HG22 ' A' ' 51' ' ' VAL . 2.1 mm? -76.14 152.25 36.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.896 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.631 HD11 ' OD2' ' A' ' 52' ' ' ASP . 64.4 mt -129.84 -172.63 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.943 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -114.48 -16.13 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 p -134.78 176.85 8.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.2 t -107.57 108.55 19.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.8 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -107.8 173.43 6.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -67.87 -29.18 68.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.858 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-20 -91.48 13.25 18.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.484 ' OG ' HG22 ' A' ' 50' ' ' ILE . 28.4 t -130.98 158.32 40.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.864 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.6 t -133.58 135.76 55.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.5 t -77.96 140.45 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.114 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.738 HD11 HD23 ' A' ' 107' ' ' LEU . 11.4 mt -131.91 131.09 42.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.631 HG12 ' ND2' ' A' ' 72' ' ' ASN . 14.4 t -112.83 103.96 16.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.142 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.6 HD21 HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -94.67 96.58 9.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.631 ' ND2' HG12 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -175.94 -168.9 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.868 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 68.01 0.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.914 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.424 HG23 ' O ' ' A' ' 83' ' ' CYS . 13.3 mt -81.24 141.24 15.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.138 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.75 168.83 18.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -106.49 163.56 12.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.911 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.59 168.01 11.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.099 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -68.26 -27.61 66.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -95.61 26.6 3.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.888 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt 64.22 15.52 9.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.8 m -82.59 146.46 29.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.834 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.449 ' N ' HD22 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -103.5 149.64 24.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.424 ' O ' HG23 ' A' ' 74' ' ' ILE . 20.7 p -151.14 162.72 40.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.4 ttm -126.14 150.06 48.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.822 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -87.29 128.24 8.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.507 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.429 ' CD1' HG11 ' A' ' 28' ' ' VAL . 39.7 mt -146.2 111.86 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.811 0.338 . . . . 0.0 111.115 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 59.17 47.52 11.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 63.7 16.25 9.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -127.44 124.15 37.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -85.72 117.54 24.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -109.14 130.7 55.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.48 148.34 48.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.905 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.679 HD12 ' HZ ' ' A' ' 19' ' ' PHE . 4.7 pt -118.24 133.5 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.105 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 93' ' ' ILE . 4.6 mm? -127.16 159.46 64.94 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.622 0.725 . . . . 0.0 110.947 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 53.6 Cg_endo -69.76 148.87 65.99 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 0.0 112.361 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -59.93 -20.14 55.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 49.5 m -69.23 -17.28 63.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -0.43 41.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.6 mmtt -51.17 165.97 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 96.93 -41.47 2.34 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.5 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -112.41 -21.31 11.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.865 0.364 . . . . 0.0 111.116 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.13 146.68 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.163 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -129.45 166.33 19.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.947 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.48 168.02 0.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.095 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.612 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -68.52 164.89 20.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.612 ' N ' HD12 ' A' ' 105' ' ' LEU . 21.4 mtt85 -111.93 139.41 47.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.883 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.738 HD23 HD11 ' A' ' 69' ' ' LEU . 0.5 OUTLIER -71.65 -14.83 62.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.921 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -62.22 -17.06 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -78.78 -2.95 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.997 ' O ' ' C ' ' A' ' 110' ' ' PHE . 22.5 m-85 . . . . . 1 C--O 2.0 40.583 1 CA-C-O 161.141 19.543 . . . . 0.0 110.877 179.99 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -119.94 141.9 49.22 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . 0.263 23.8 p 58.45 7.34 0.69 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.848 2.859 . . . . 0.0 113.622 -179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 m -65.6 -0.48 2.06 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 128.558 2.743 . . . . 0.0 115.346 -179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -138.83 129.69 26.44 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 119.949 1.249 . . . . 0.0 107.705 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -148.46 179.13 8.03 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 126.206 1.802 . . . . 0.0 108.107 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -70.96 161.33 31.28 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.3 t -129.61 140.15 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 105.785 -1.932 . . . . 0.0 105.785 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -103.3 118.26 36.36 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -95.22 146.08 24.59 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -62.35 -34.87 77.51 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 64.28 133.59 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.702 2.001 . . . . 0.0 111.846 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 61.51 19.59 58.05 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.073 -1.017 . . . . 0.0 112.1 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -136.11 178.07 7.35 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.855 2.062 . . . . 0.0 109.983 -179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -169.56 0.78 Allowed 'General case' 0 C--O 1.239 0.505 0 C-N-CA 127.372 2.269 . . . . 0.0 107.771 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.2 p -79.96 120.74 24.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.378 -1.451 . . . . 0.0 107.743 -176.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -167.66 138.85 2.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.399 3.08 . . . . 0.0 106.117 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 35.9 p90 -162.15 177.94 9.23 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 123.561 0.744 . . . . 0.0 109.749 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.8 mt -137.93 122.92 23.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 C-N-CA 123.624 0.77 . . . . 0.0 109.272 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 71.6 t80 -131.65 142.94 49.97 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.44 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 23.4 t70 56.32 34.31 23.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.809 1.244 . . . . 0.0 108.852 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 m120 62.35 12.05 4.98 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 127.254 2.222 . . . . 0.0 112.289 -178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.36 146.47 39.42 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 119.223 0.92 . . . . 0.0 109.235 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.1 m -75.38 133.48 41.18 Favored 'General case' 0 N--CA 1.438 -1.06 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.302 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.6 m-85 -141.84 162.09 36.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.611 1.565 . . . . 0.0 109.123 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -148.56 161.73 41.08 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 121.031 -1.043 . . . . 0.0 108.619 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -91.79 130.76 40.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -100.19 169.83 8.87 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.128 0.971 . . . . 0.0 111.385 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.76 -14.63 61.15 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 126.935 2.094 . . . . 0.0 111.797 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -69.91 124.36 23.83 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 124.801 1.24 . . . . 0.0 109.693 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.32 144.74 40.02 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.421 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -123.74 138.7 30.85 Favored Pre-proline 0 CA--C 1.544 0.721 0 C-N-CA 125.384 1.474 . . . . 0.0 107.807 -178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.33 153.51 50.72 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.392 2.061 . . . . 0.0 112.646 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -50.39 -33.84 22.1 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 126.298 1.839 . . . . 0.0 114.45 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.499 ' HG3' HD22 ' A' ' 37' ' ' ASN . 5.8 pt-20 -67.82 -27.56 66.83 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.344 0.658 . . . . 0.0 111.625 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.499 HD22 ' HG3' ' A' ' 36' ' ' GLU . 1.9 m-80 -82.45 -24.76 34.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 179.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -67.13 119.51 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -74.21 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.58 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.62 172.37 15.48 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.06 0.544 . . . . 0.0 111.2 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.1 t -60.74 157.86 13.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.411 1.484 . . . . 0.0 108.722 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.544 ' HE2' ' CD1' ' A' ' 82' ' ' LEU . 3.7 tttp -133.43 -51.22 0.87 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 117.498 -1.239 . . . . 0.0 111.299 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -144.28 112.05 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.258 0.936 . . . . 0.0 111.408 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.1 mttp -84.41 92.62 8.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.41 156.65 38.5 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 130.019 3.328 . . . . 0.0 105.981 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -135.93 121.63 19.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.714 1.605 . . . . 0.0 110.145 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.482 ' CE ' HD23 ' A' ' 49' ' ' LEU . 3.7 tmtm? -147.45 132.77 18.5 Favored 'General case' 0 C--O 1.227 -0.129 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.0 tt -134.45 143.23 47.41 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 126.924 2.09 . . . . 0.0 106.249 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.482 HD23 ' CE ' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -157.61 167.56 29.79 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.747 1.619 . . . . 0.0 107.695 178.113 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.5 mt -126.62 127.42 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.0 t -112.48 139.85 35.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.069 1.347 . . . . 0.0 109.584 -179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -87.01 120.86 28.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.153 1.381 . . . . 0.0 108.507 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.6 mtp -64.72 -21.07 66.67 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -77.01 -53.49 7.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 120.967 1.712 . . . . 0.0 111.937 -179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.5 m -96.9 -6.51 35.58 Favored 'General case' 0 CA--C 1.523 -0.072 0 CA-C-O 118.097 -0.954 . . . . 0.0 113.394 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 65.15 21.9 12.2 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -101.22 157.43 16.78 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 124.823 1.249 . . . . 0.0 111.088 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.82 152.83 33.26 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.409 ' CD1' HD22 ' A' ' 63' ' ' ASN . 69.0 mt -127.21 169.09 13.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.128 0.971 . . . . 0.0 109.814 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.2 p -109.99 11.56 23.96 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 126.988 2.115 . . . . 0.0 108.991 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.3 p -155.0 169.23 24.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.045 1.338 . . . . 0.0 111.714 -179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.8 t -101.62 110.84 22.91 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.409 HD22 ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER -117.64 157.2 26.85 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.573 0.749 . . . . 0.0 109.206 178.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -32.25 69.94 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.628 1.558 . . . . 0.0 113.704 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -85.02 15.43 4.07 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.353 1.061 . . . . 0.0 109.896 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 p -120.88 162.85 19.12 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.676 1.19 . . . . 0.0 110.55 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.5 t -137.77 130.63 41.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.3 t -80.25 134.09 36.06 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 106.039 -1.838 . . . . 0.0 106.039 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.3 125.51 43.63 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 t -104.69 103.01 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 102.879 -3.008 . . . . 0.0 102.879 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -96.34 91.86 6.05 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -168.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -175.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 48.07 67.17 0.88 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.825 1.25 . . . . 0.0 111.598 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -72.02 144.9 12.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.932 1.293 . . . . 0.0 111.697 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -138.25 169.25 18.12 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.295 2.238 . . . . 0.0 110.403 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -117.15 162.71 17.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 127.123 2.169 . . . . 0.0 108.139 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.15 175.41 6.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.396 1.878 . . . . 0.0 111.358 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -53.27 -48.04 68.63 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.03 1.732 . . . . 0.0 111.754 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -85.48 18.86 2.56 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.083 -1.01 . . . . 0.0 111.936 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.11 8.91 5.98 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.534 1.933 . . . . 0.0 109.723 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -64.52 157.03 27.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.544 ' CD1' ' HE2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -116.17 155.28 28.54 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.334 -0.854 . . . . 0.0 111.361 -177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.9 p -151.54 168.89 23.51 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.6 ttm -135.98 143.65 44.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.724 1.609 . . . . 0.0 109.737 -178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.73 125.37 7.03 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 109.796 -1.321 . . . . 0.0 109.796 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.1 mt -143.38 121.73 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 50.84 35.72 12.92 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.574 0.75 . . . . 0.0 111.084 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 74.63 12.51 3.75 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 126.17 1.788 . . . . 0.0 114.31 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -120.04 135.64 54.86 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.639 1.175 . . . . 0.0 109.006 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -88.86 115.83 26.7 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.476 0.711 . . . . 0.0 110.591 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -109.18 131.54 54.97 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.517 1.127 . . . . 0.0 111.247 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.421 ' HB2' HD13 ' A' ' 33' ' ' ILE . 10.6 ttpt -65.77 148.74 51.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 123.977 0.911 . . . . 0.0 110.31 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.414 HD11 ' HB3' ' A' ' 82' ' ' LEU . 1.3 pt -117.65 133.04 65.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -121.61 159.72 49.45 Favored Pre-proline 0 N--CA 1.467 0.405 0 C-N-CA 125.575 1.55 . . . . 0.0 109.21 -178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -71.98 151.36 56.13 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.07 1.847 . . . . 0.0 109.022 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.01 -5.68 5.01 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 p -80.16 -23.68 40.9 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.133 1.373 . . . . 0.0 111.181 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -72.31 -0.26 11.8 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.305 1.842 . . . . 0.0 114.539 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.1 mmtt -51.85 157.09 1.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.976 1.311 . . . . 0.0 111.272 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.1 -26.37 17.41 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.465 1.031 . . . . 0.0 111.483 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.03 -12.44 11.97 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.15 1.38 . . . . 0.0 110.149 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.8 p -150.26 150.27 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.901 0 C-N-CA 124.743 1.217 . . . . 0.0 108.127 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -129.82 173.0 11.08 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.895 2.478 . . . . 0.0 105.336 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.57 166.35 5.38 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.867 0.841 . . . . 0.0 111.043 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -61.58 162.48 8.25 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.012 0.925 . . . . 0.0 110.162 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.572 ' N ' HD12 ' A' ' 105' ' ' LEU . 86.2 mtt180 -111.5 138.82 47.52 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.445 0.698 . . . . 0.0 112.169 -178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.437 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.1 OUTLIER -70.61 -16.4 62.83 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 111.172 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -67.61 -3.82 10.05 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.637 1.175 . . . . 0.0 112.855 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -90.73 4.2 52.21 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 120.858 -1.152 . . . . 0.0 110.251 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 126.437 1.895 . . . . 0.0 107.994 -178.803 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -156.44 138.29 14.33 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.227 -0.921 . . . . 0.0 109.105 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.61 137.47 26.73 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.247 1.419 . . . . 0.0 108.87 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.6 p -156.44 164.37 38.33 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.38 -0.825 . . . . 0.0 111.52 -179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -151.24 127.39 10.51 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 126.639 1.976 . . . . 0.0 111.892 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -156.79 158.54 37.01 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.115 1.766 . . . . 0.0 107.608 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -63.75 150.83 43.67 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.9 t -107.32 136.98 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.7 119.12 38.46 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 106.147 -1.798 . . . . 0.0 106.147 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -93.54 172.21 8.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.871 1.268 . . . . 0.0 110.125 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -65.02 -25.4 67.83 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 128.39 2.676 . . . . 0.0 114.695 178.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 45.12 92.96 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.919 2.087 . . . . 0.0 114.264 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 31.55 50.52 Favored Glycine 0 CA--C 1.525 0.665 0 CA-C-N 113.325 -1.761 . . . . 0.0 113.18 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -136.01 -178.96 5.38 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 127.392 2.277 . . . . 0.0 110.434 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.99 -170.99 0.8 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.873 1.269 . . . . 0.0 108.404 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -79.13 120.44 23.66 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.783 -1.823 . . . . 0.0 110.274 -175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -168.99 145.47 3.51 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 129.014 2.926 . . . . 0.0 107.421 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.475 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 45.4 p90 -165.15 166.42 19.03 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mp -123.16 121.87 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 O-C-N 120.886 -1.134 . . . . 0.0 108.715 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -131.82 140.31 49.11 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 55.23 36.69 27.56 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.29 1.036 . . . . 0.0 110.72 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 m120 59.49 18.91 7.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.886 1.674 . . . . 0.0 112.753 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.95 140.01 50.7 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 126.273 1.829 . . . . 0.0 106.148 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 m -80.0 140.51 36.56 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.5 m-85 -140.83 162.83 34.5 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.479 1.912 . . . . 0.0 110.72 -178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CD1' ' HE2' ' A' ' 99' ' ' LYS . 47.6 p90 -149.46 159.78 44.01 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.9 1.28 . . . . 0.0 109.64 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.5 t -89.06 133.47 31.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.0 p -99.67 169.95 8.91 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.206 1.003 . . . . 0.0 111.454 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -71.95 -21.01 61.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 128.64 2.776 . . . . 0.0 112.751 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 126.45 30.75 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.336 1.454 . . . . 0.0 112.711 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -99.31 147.68 24.94 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.82 2.048 . . . . 0.0 109.418 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.411 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -114.3 127.41 26.85 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.26 148.1 79.62 Favored 'Trans proline' 0 N--CA 1.451 -0.977 0 C-N-CA 121.57 1.513 . . . . 0.0 110.666 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.74 -27.22 49.45 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -72.02 -19.79 61.8 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.441 0.696 . . . . 0.0 111.94 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -90.55 -21.66 21.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.72 -0.612 . . . . 0.0 110.102 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 82.5 t -59.49 137.26 22.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 C-N-CA 124.905 1.282 . . . . 0.0 107.736 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.452 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.1 OUTLIER -91.12 -61.66 1.61 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 118.538 -0.744 . . . . 0.0 109.16 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -161.29 167.56 25.67 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.049 0.84 . . . . 0.0 112.057 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 36.9 m -69.4 133.79 48.22 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.769 1.228 . . . . 0.0 108.741 178.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.38 -57.02 2.09 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 117.697 -1.145 . . . . 0.0 111.902 -178.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.1 t -141.0 121.99 13.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -84.98 117.6 24.06 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 105.025 -2.213 . . . . 0.0 105.025 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.19 159.74 43.28 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 128.584 2.754 . . . . 0.0 109.541 -177.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -141.33 121.4 13.74 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.112 -0.992 . . . . 0.0 108.908 177.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 48' ' ' LEU . 2.1 tmtm? -148.14 137.44 22.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.463 ' N ' ' HD3' ' A' ' 47' ' ' LYS . 8.3 tt -134.93 143.29 46.82 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.775 2.03 . . . . 0.0 108.211 177.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -155.69 170.0 23.04 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.439 1.496 . . . . 0.0 109.539 177.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 mt -129.46 129.76 67.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.3 t -128.36 134.04 65.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 124.473 1.109 . . . . 0.0 111.04 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -71.13 117.52 12.75 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 128.12 2.568 . . . . 0.0 108.06 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.6 mtp -67.83 -23.27 65.15 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.833 1.197 . . . . 0.0 113.314 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.5 mmmm -69.61 -53.37 19.15 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.972 0.805 . . . . 0.0 110.21 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.1 m -106.78 -2.93 20.98 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 117.07 2.248 . . . . 0.0 117.07 -177.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 59.05 35.08 23.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.823 1.249 . . . . 0.0 112.128 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -116.73 148.37 41.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.482 1.113 . . . . 0.0 109.289 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.7 155.05 40.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.837 0.351 . . . . 0.0 110.608 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 79.1 mt -131.3 170.59 14.4 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 109.807 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.4 p -92.36 -27.48 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.669 1.187 . . . . 0.0 112.714 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.0 m -135.83 163.33 30.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.06 1.344 . . . . 0.0 110.392 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t -88.11 109.74 20.11 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.453 1.501 . . . . 0.0 110.166 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -119.09 157.95 26.83 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -55.81 -18.75 9.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -92.04 7.8 40.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 119.538 1.063 . . . . 0.0 110.356 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.1 t -133.83 166.89 21.61 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.473 1.909 . . . . 0.0 111.041 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -142.2 156.21 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.99 1.716 . . . . 0.0 107.878 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.2 t -105.69 143.9 33.19 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.27 1.428 . . . . 0.0 108.577 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -132.44 133.69 44.17 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 15.0 t -104.52 102.3 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 103.846 -2.65 . . . . 0.0 103.846 178.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -82.83 95.62 7.97 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.55 -173.42 3.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 47.27 68.77 0.59 Allowed 'General case' 0 C--N 1.342 0.248 0 C-N-CA 127.694 2.398 . . . . 0.0 112.705 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.5 mt -72.45 140.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 44.5 m-85 -134.64 170.27 16.05 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 127.284 2.233 . . . . 0.0 109.218 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -117.65 152.62 34.82 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 126.077 1.751 . . . . 0.0 108.079 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -106.8 165.57 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.965 1.706 . . . . 0.0 109.216 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.2 t -61.56 -24.77 66.88 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.896 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -81.88 7.93 11.63 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.577 2.351 . . . . 0.0 110.042 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt 68.84 -0.8 2.24 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.32 2.248 . . . . 0.0 109.794 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.1 t -75.16 168.57 19.73 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.434 ' CB ' HD11 ' A' ' 93' ' ' ILE . 2.0 mm? -114.81 156.18 25.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.401 1.081 . . . . 0.0 111.853 -178.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 23.3 p -145.8 166.48 25.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.842 0.857 . . . . 0.0 110.384 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 52.9 ttm -132.52 140.15 48.2 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.889 1.676 . . . . 0.0 109.285 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.15 110.23 3.31 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 124.884 1.23 . . . . 0.0 112.838 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.8 mt -130.55 124.37 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.154 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 49.59 53.67 12.33 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.436 2.294 . . . . 0.0 109.233 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 59.95 11.8 2.79 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.861 2.065 . . . . 0.0 114.825 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -119.43 132.89 55.9 Favored 'General case' 0 CA--C 1.514 -0.405 0 O-C-N 120.95 -1.094 . . . . 0.0 109.715 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -86.17 115.82 23.98 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -108.44 132.2 54.02 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.179 0.992 . . . . 0.0 110.56 -178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.411 ' HB2' HD13 ' A' ' 33' ' ' ILE . 16.9 ttpt -65.26 151.17 46.85 Favored 'General case' 0 C--O 1.238 0.449 0 O-C-N 122.053 -0.405 . . . . 0.0 111.023 -178.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.475 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -117.25 133.22 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -121.26 157.7 55.11 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 125.274 1.43 . . . . 0.0 109.208 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.27 153.78 56.43 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 124.031 3.154 . . . . 0.0 110.846 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.57 -17.93 57.08 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.111 0.564 . . . . 0.0 111.544 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.9 m -77.0 -20.73 55.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.057 -0.497 . . . . 0.0 111.993 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.77 -0.16 41.85 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.901 0.773 . . . . 0.0 110.737 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.442 ' HE2' ' CD1' ' A' ' 27' ' ' PHE . 61.7 mmtt -59.98 150.75 28.07 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 102.09 -31.9 8.16 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 109.136 -1.585 . . . . 0.0 109.136 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -104.2 -19.36 14.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.93 1.692 . . . . 0.0 110.167 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 p -148.79 154.16 10.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 C-N-CA 127.407 2.283 . . . . 0.0 106.854 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -131.34 170.87 14.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.718 1.607 . . . . 0.0 108.622 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.43 165.2 14.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.9 168.4 13.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -113.25 140.23 48.14 Favored 'General case' 0 CA--C 1.514 -0.422 0 C-N-CA 125.159 1.384 . . . . 0.0 109.454 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.406 HD12 ' H ' ' A' ' 107' ' ' LEU . 2.6 mp -71.47 -13.2 61.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.108 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -56.93 -26.72 59.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.949 0.9 . . . . 0.0 111.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -64.38 -19.65 65.62 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.197 1.399 . . . . 0.0 112.821 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.375 1.87 . . . . 0.0 111.646 -177.012 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 16.4 t80 . . . . . 0 CA--C 1.533 0.289 0 CA-C-O 121.13 0.491 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.2 mm-40 -155.84 69.67 0.68 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.0 p -143.92 163.83 32.3 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.799 0.84 . . . . 0.0 110.162 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.5 p -115.61 -61.42 1.74 Allowed 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.025 1.33 . . . . 0.0 109.13 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -71.63 -37.21 70.91 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt 52.22 43.75 30.35 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.068 1.347 . . . . 0.0 109.945 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -48.81 138.79 10.72 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.933 0.893 . . . . 0.0 111.047 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -90.55 118.7 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.462 ' HD2' HD13 ' A' ' 20' ' ' ILE . 10.8 ttm180 -84.59 100.65 11.56 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.42 138.94 40.68 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -64.95 -34.67 78.96 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 115.351 1.611 . . . . 0.0 115.351 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 57.86 139.86 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.899 2.079 . . . . 0.0 114.751 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 62.36 15.87 52.97 Favored Glycine 0 CA--C 1.534 1.273 0 O-C-N 121.156 -0.965 . . . . 0.0 111.965 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.11 177.33 7.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 127.644 2.378 . . . . 0.0 108.914 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -167.31 0.49 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 131.038 3.735 . . . . 0.0 109.24 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.285 24.2 p -78.76 119.07 21.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 123.771 1.748 . . . . 0.0 106.985 -176.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.13 139.75 2.87 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 130.974 3.71 . . . . 0.0 107.676 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -162.6 156.75 21.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 128.116 2.566 . . . . 0.0 107.08 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.462 HD13 ' HD2' ' A' ' 10' ' ' ARG . 2.2 mp -118.92 126.24 75.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 123.618 0.767 . . . . 0.0 108.971 -179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -131.5 138.66 49.06 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.291 1.036 . . . . 0.0 110.046 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.9 t70 54.05 34.16 19.24 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.343 1.857 . . . . 0.0 113.071 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 66.02 31.48 9.03 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.211 1.804 . . . . 0.0 110.923 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -134.62 127.66 31.62 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 126.168 1.787 . . . . 0.0 106.641 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.6 m -76.16 132.11 39.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.95 172.59 9.27 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 127.951 2.5 . . . . 0.0 111.797 -177.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.316 25.9 p90 -153.19 144.79 23.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 129.486 3.114 . . . . 0.0 113.63 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 93' ' ' ILE . 47.3 t -82.52 133.84 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.6 p -103.57 167.88 9.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.694 1.198 . . . . 0.0 110.107 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -72.14 -12.0 61.0 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.895 1.678 . . . . 0.0 113.201 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 111.44 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.911 1.284 . . . . 0.0 113.238 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.409 ' C ' HD12 ' A' ' 33' ' ' ILE . 57.7 tt0 -89.92 146.71 24.2 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.424 1.49 . . . . 0.0 109.29 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.409 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.68 140.04 24.84 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.697 1.599 . . . . 0.0 107.929 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.81 150.35 61.69 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.817 . . . . 0.0 110.672 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -61.37 -19.42 61.84 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 113.842 1.052 . . . . 0.0 113.842 -178.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.51 -21.44 60.4 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.375 0.67 . . . . 0.0 110.588 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.69 -20.04 26.82 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.836 0.454 . . . . 0.0 111.554 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.0 t -61.3 130.45 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -89.87 -57.96 2.68 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.505 1.122 . . . . 0.0 110.5 -179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -164.05 172.33 13.96 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.079 0.952 . . . . 0.0 110.514 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.8 p -68.16 162.7 24.25 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -137.28 -45.07 0.56 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.33 122.81 2.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 118.598 0.635 . . . . 0.0 112.069 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -99.9 112.13 24.41 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -150.05 156.45 41.69 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 129.302 3.041 . . . . 0.0 104.893 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -131.8 119.36 21.15 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.46 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -148.12 135.12 20.21 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.46 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.1 tt -137.88 138.18 38.81 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 127.238 2.215 . . . . 0.0 109.147 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -144.42 169.65 17.53 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.991 0.916 . . . . 0.0 110.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.59 128.29 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.042 1.337 . . . . 0.0 107.957 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.1 t -123.67 134.68 65.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 124.799 1.24 . . . . 0.0 108.839 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -76.92 124.24 27.47 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 54.4 mtp -68.79 -29.76 68.18 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 120.255 -1.528 . . . . 0.0 112.887 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -79.48 -53.33 6.99 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 123.526 0.73 . . . . 0.0 110.784 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -81.48 -17.03 50.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.95 -1.024 . . . . 0.0 111.76 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 59.87 37.44 21.69 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.28 0.945 . . . . 0.0 109.664 -178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -129.42 161.38 30.5 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.411 1.084 . . . . 0.0 112.392 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.47 147.08 40.13 Favored 'General case' 0 C--O 1.235 0.342 0 O-C-N 124.119 0.887 . . . . 0.0 110.061 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.8 mt -131.54 170.49 14.65 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.801 1.24 . . . . 0.0 112.112 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.83 -44.8 8.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.1 161.12 22.3 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.217 1.007 . . . . 0.0 112.665 -177.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.8 p -80.71 96.59 6.96 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -77.23 168.21 20.44 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 105.585 -2.006 . . . . 0.0 105.585 176.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -69.95 -23.32 63.17 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -80.93 2.95 24.52 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 m -119.28 161.0 21.15 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.653 1.181 . . . . 0.0 112.581 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 55.9 t -136.66 154.95 32.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 126.501 1.92 . . . . 0.0 106.144 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -108.65 143.47 37.67 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.525 HD21 HD23 ' A' ' 107' ' ' LEU . 2.0 mm? -125.54 145.52 50.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.1 t -116.46 103.06 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -101.81 94.54 5.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.97 -173.35 2.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.176 -177.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 51.35 68.09 0.85 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.058 0.943 . . . . 0.0 113.241 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mt -74.68 143.86 12.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 124.903 1.281 . . . . 0.0 109.155 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -136.64 170.22 16.42 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.381 2.272 . . . . 0.0 109.868 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -116.97 157.77 25.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 126.316 1.846 . . . . 0.0 107.699 178.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.29 165.47 15.43 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.38 1.472 . . . . 0.0 111.463 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.5 t -56.08 -36.32 67.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.587 1.555 . . . . 0.0 111.326 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -87.99 17.93 4.59 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.667 0.787 . . . . 0.0 110.969 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt 67.61 3.25 3.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.372 1.869 . . . . 0.0 111.914 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.0 m -68.63 154.87 41.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.2 mt -114.63 147.58 39.35 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.4 p -142.52 169.08 18.25 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.734 0.414 . . . . 0.0 110.987 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 tpp -128.79 140.15 51.85 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.085 2.154 . . . . 0.0 108.464 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -88.27 115.63 4.43 Favored Glycine 0 N--CA 1.462 0.391 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.492 HG22 HD22 ' A' ' 87' ' ' ASN . 45.5 mt -132.09 119.98 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.492 HD22 HG22 ' A' ' 86' ' ' ILE . 9.7 m-80 50.5 47.09 24.65 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 122.1 0.953 . . . . 0.0 111.139 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 62.7 9.94 3.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 128.69 2.796 . . . . 0.0 113.672 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -112.08 125.3 53.95 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.613 1.565 . . . . 0.0 107.989 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -86.14 116.03 24.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.43 132.11 54.1 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.573 1.149 . . . . 0.0 109.402 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -63.61 155.46 29.62 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.465 0.706 . . . . 0.0 112.632 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -124.62 132.69 70.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 178.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.29 160.05 59.57 Favored Pre-proline 0 N--CA 1.474 0.767 0 C-N-CA 126.026 1.73 . . . . 0.0 110.248 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.52 152.32 78.62 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.778 2.319 . . . . 0.0 109.835 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -60.64 -14.82 22.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.56 -0.257 . . . . 0.0 111.666 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.92 -13.64 62.55 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.283 -0.886 . . . . 0.0 110.953 177.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -2.75 40.53 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.829 1.195 . . . . 0.0 111.277 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp -52.47 152.16 3.72 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 120.846 -1.159 . . . . 0.0 110.954 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.68 -42.34 3.04 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -95.65 -14.0 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.211 1.506 . . . . 0.0 110.9 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 20.0 t -143.13 155.06 16.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 C-N-CA 126.818 2.047 . . . . 0.0 106.996 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -133.75 162.38 32.12 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.208 1.003 . . . . 0.0 109.08 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.33 159.7 26.19 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 165.09 13.56 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -125.27 140.34 52.92 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 110.215 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.711 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.0 OUTLIER -65.04 -12.85 55.13 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 126.369 1.868 . . . . 0.0 112.692 179.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.31 -16.68 48.31 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.417 1.008 . . . . 0.0 112.15 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -81.49 -5.02 57.53 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.412 0.685 . . . . 0.0 110.981 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.873 2.069 . . . . 0.0 107.045 -179.705 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.45 160.3 16.58 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.469 1.908 . . . . 0.0 111.26 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.2 p -130.0 25.71 5.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.919 1.288 . . . . 0.0 113.797 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 t 56.51 17.89 3.25 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 120.887 -1.133 . . . . 0.0 113.625 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 56.73 32.39 21.1 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.353 1.461 . . . . 0.0 113.245 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 10.6 mmpt? -127.86 159.04 36.13 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.602 1.561 . . . . 0.0 109.113 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.25 171.97 13.02 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.956 1.303 . . . . 0.0 109.488 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.2 t -124.45 144.16 35.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 124.414 1.086 . . . . 0.0 110.26 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.9 ttm180 -112.56 138.13 49.8 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -113.41 152.17 30.4 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.69 -25.84 68.12 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.659 0.784 . . . . 0.0 111.622 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.8 137.99 0.03 OUTLIER 'General case' 0 C--O 1.236 0.383 0 C-N-CA 129.327 3.051 . . . . 0.0 112.022 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.95 38.04 30.38 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.881 1.229 . . . . 0.0 111.545 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -139.82 179.04 6.82 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.347 1.859 . . . . 0.0 112.307 -176.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -74.67 -169.19 0.82 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 128.532 2.733 . . . . 0.0 107.91 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.254 22.8 p -80.16 120.46 24.32 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 119.385 -2.072 . . . . 0.0 109.363 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -168.83 143.41 3.18 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 129.604 3.161 . . . . 0.0 106.548 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 41.3 p90 -164.44 173.17 12.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 119.285 0.948 . . . . 0.0 109.139 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -130.67 123.27 54.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 O-C-N 121.538 -0.726 . . . . 0.0 109.512 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -137.26 145.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 104.632 -2.358 . . . . 0.0 104.632 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.1 t0 53.47 35.33 20.38 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 122.419 1.104 . . . . 0.0 111.399 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 57.59 22.83 8.61 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.347 1.859 . . . . 0.0 113.126 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -123.41 150.77 43.36 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 125.618 1.567 . . . . 0.0 109.305 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.8 m -79.29 123.05 27.08 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 8.4 m-85 -127.5 161.35 28.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.423 1.489 . . . . 0.0 109.087 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' CE2' HG22 ' A' ' 29' ' ' THR . 31.3 p90 -149.17 167.38 26.12 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.004 -1.06 . . . . 0.0 108.408 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -97.45 127.58 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 ' CE2' ' A' ' 27' ' ' PHE . 30.3 p -94.99 167.49 11.36 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.752 1.221 . . . . 0.0 111.689 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -75.15 -13.0 60.42 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.978 1.711 . . . . 0.0 111.988 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HE2' HG13 ' A' ' 102' ' ' VAL . 1.7 mptp? -69.59 102.77 1.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.645 1.578 . . . . 0.0 109.6 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -89.93 145.64 24.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -111.47 139.93 22.55 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 126.599 1.959 . . . . 0.0 108.823 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.59 148.61 20.59 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.26 2.64 . . . . 0.0 109.893 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -55.27 -31.97 61.99 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.26 -19.39 64.51 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.58 0.752 . . . . 0.0 112.629 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -101.84 -9.76 20.48 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.523 0.729 . . . . 0.0 111.064 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.6 t -74.87 124.2 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -73.66 -59.57 2.65 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.375 1.07 . . . . 0.0 110.799 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.19 169.07 6.58 Favored 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 126.172 1.789 . . . . 0.0 109.63 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 57.5 p -62.48 169.61 2.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.301 1.84 . . . . 0.0 112.913 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -140.51 -47.71 0.43 Allowed 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 116.746 -1.597 . . . . 0.0 114.364 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 t -153.06 130.02 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 121.248 1.84 . . . . 0.0 111.416 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -99.29 106.13 18.22 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.296 1.038 . . . . 0.0 111.042 179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -128.87 158.04 39.87 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 129.65 3.18 . . . . 0.0 106.166 178.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.03 109.83 6.06 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.487 1.04 . . . . 0.0 109.761 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.36 139.0 22.85 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 118.985 0.811 . . . . 0.0 109.898 178.037 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.506 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 10.2 tt -133.53 141.76 47.89 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 125.465 1.506 . . . . 0.0 108.53 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.584 HD11 HD21 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -148.92 171.16 16.78 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.183 1.393 . . . . 0.0 110.74 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.4 mt -127.3 142.57 43.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.76 1.224 . . . . 0.0 110.725 -178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.5 t -137.48 128.83 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.711 1.204 . . . . 0.0 111.712 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.48 ' HB2' HD21 ' A' ' 59' ' ' LEU . 9.4 t0 -73.62 111.48 8.8 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.801 1.64 . . . . 0.0 108.041 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 63.0 mtp -56.99 -25.22 57.96 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.355 1.434 . . . . 0.0 113.494 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? -60.09 -53.52 56.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.947 0.499 . . . . 0.0 111.05 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.5 m -106.12 -6.54 18.53 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 59.57 30.84 20.51 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.803 2.041 . . . . 0.0 109.878 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.94 154.01 24.71 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 124.923 1.289 . . . . 0.0 112.34 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.11 150.1 49.25 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.22 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.48 HD21 ' HB2' ' A' ' 52' ' ' ASP . 54.3 mt -127.45 174.31 9.11 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 124.417 1.087 . . . . 0.0 110.781 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 p -108.96 0.45 20.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 126.802 2.041 . . . . 0.0 113.028 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.1 p -163.01 162.98 26.22 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.543 1.137 . . . . 0.0 108.413 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.7 m -91.72 117.43 29.75 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.486 1.914 . . . . 0.0 112.818 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -124.35 157.22 35.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.97 1.708 . . . . 0.0 109.317 177.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -56.28 -18.03 9.39 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 117.116 2.265 . . . . 0.0 117.116 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -96.66 4.18 52.04 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.364 0.666 . . . . 0.0 111.072 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.5 t -120.32 169.53 10.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.995 2.118 . . . . 0.0 107.92 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 92.5 t -143.47 145.38 22.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 t -95.46 142.18 28.13 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 106.479 -1.675 . . . . 0.0 106.479 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.2 mt -123.6 151.73 42.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.7 t -128.49 104.33 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 105.332 -2.099 . . . . 0.0 105.332 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 49' ' ' LEU . 2.1 mm? -97.94 95.12 7.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.601 1.092 . . . . 0.0 109.837 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.49 -167.75 0.93 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 56.0 67.9 0.94 Allowed 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.418 1.087 . . . . 0.0 113.701 175.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.3 mt -77.87 139.99 17.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 121.195 -0.941 . . . . 0.0 109.038 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.82 168.41 19.88 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.834 2.054 . . . . 0.0 109.229 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -115.23 151.22 34.87 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 126.363 1.865 . . . . 0.0 107.204 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.12 159.99 16.43 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 125.527 1.531 . . . . 0.0 109.837 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -59.54 -33.24 71.15 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.986 0.914 . . . . 0.0 110.779 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -83.05 17.0 2.1 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.877 1.271 . . . . 0.0 110.405 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp 68.65 2.09 3.29 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 126.84 2.056 . . . . 0.0 111.142 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 44.3 m -70.01 160.98 30.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.95 146.09 41.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.542 1.137 . . . . 0.0 108.145 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.2 p -142.48 167.14 22.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.542 -0.724 . . . . 0.0 110.609 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 36.0 ttm -134.13 137.47 44.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.552 1.941 . . . . 0.0 109.029 -178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.6 123.38 6.03 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 127.336 2.398 . . . . 0.0 111.087 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.7 mt -138.98 117.32 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.404 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 50.67 43.69 27.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.901 0.881 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 73.94 -1.28 3.11 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 128.123 2.569 . . . . 0.0 115.357 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -105.45 134.76 48.04 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.968 1.307 . . . . 0.0 108.6 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -89.89 117.09 28.45 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.12 0.568 . . . . 0.0 109.819 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -109.02 130.24 55.47 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.289 1.436 . . . . 0.0 110.742 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -62.89 147.76 49.29 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.308 0.643 . . . . 0.0 110.387 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -115.95 133.46 62.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.21 161.05 56.56 Favored Pre-proline 0 C--O 1.236 0.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.952 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -74.95 144.29 30.26 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 122.696 2.264 . . . . 0.0 109.05 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -58.11 -18.18 23.31 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.78 -11.1 59.99 Favored 'General case' 0 N--CA 1.445 -0.71 0 O-C-N 121.006 -1.059 . . . . 0.0 112.571 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.5 1.66 28.5 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.34 1.427 . . . . 0.0 112.426 178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -46.11 144.42 1.94 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 126.606 1.962 . . . . 0.0 112.279 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.43 -43.11 1.94 Allowed Glycine 0 CA--C 1.518 0.251 0 C-N-CA 127.172 2.32 . . . . 0.0 110.662 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.06 -18.17 22.1 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 117.936 0.868 . . . . 0.0 110.457 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.4 HG13 ' HE2' ' A' ' 31' ' ' LYS . 2.0 t -138.62 158.1 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 125.832 1.653 . . . . 0.0 107.713 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -141.98 168.63 19.28 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 127.938 2.495 . . . . 0.0 106.629 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.63 -179.66 1.46 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.744 0.783 . . . . 0.0 111.038 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.95 173.25 10.23 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -123.39 141.86 51.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.719 1.208 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.429 HD12 ' H ' ' A' ' 107' ' ' LEU . 1.1 mp -69.97 -8.84 52.29 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.403 0.681 . . . . 0.0 111.787 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.24 -22.37 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.964 1.706 . . . . 0.0 110.942 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.97 -5.57 49.16 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.524 -0.751 . . . . 0.0 112.833 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 124.843 1.257 . . . . 0.0 111.556 -177.979 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -129.78 125.45 35.82 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.204 1.002 . . . . 0.0 109.223 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.4 t -104.39 165.11 11.27 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.499 1.52 . . . . 0.0 108.359 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -143.04 -33.17 0.45 Allowed 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 49.76 63.47 2.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 120.513 1.506 . . . . 0.0 110.692 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -122.42 174.97 6.7 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.375 1.47 . . . . 0.0 109.276 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 14.6 ttmm -99.75 168.61 9.8 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.417 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 24.1 t -126.71 126.12 68.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -91.67 135.72 33.67 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 106.927 -1.509 . . . . 0.0 106.927 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -106.18 165.35 11.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -78.49 -33.54 48.11 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 53.19 98.08 0.01 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.996 1.718 . . . . 0.0 113.386 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 9.25 37.46 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 125.466 1.508 . . . . 0.0 112.955 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.9 m -131.6 178.68 6.55 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 127.39 2.276 . . . . 0.0 109.469 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.4 -167.9 0.48 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 130.733 3.613 . . . . 0.0 107.833 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 22.4 p -78.87 121.13 24.44 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 124.317 2.008 . . . . 0.0 109.642 -176.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -167.0 143.84 4.58 Favored 'General case' 0 N--CA 1.448 -0.558 1 C-N-CA 132.299 4.24 . . . . 0.0 104.6 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.426 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 29.4 p90 -165.2 171.26 13.9 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 125.044 1.338 . . . . 0.0 107.447 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -132.72 123.53 49.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 O-C-N 121.558 -0.714 . . . . 0.0 109.533 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -128.07 136.64 51.49 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 125.515 1.526 . . . . 0.0 107.019 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.4 t70 52.45 34.95 16.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.272 1.429 . . . . 0.0 110.355 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 64.64 12.73 7.78 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.795 2.038 . . . . 0.0 112.593 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -106.38 138.08 43.2 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 126.216 1.807 . . . . 0.0 108.299 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -68.72 136.64 53.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.3 m-85 -144.9 159.27 43.17 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.976 0.911 . . . . 0.0 109.275 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -149.36 164.26 35.4 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.394 -0.816 . . . . 0.0 109.174 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.8 t -97.63 132.31 42.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.27 175.57 5.43 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.379 0.609 . . . . 0.0 109.729 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -77.06 -11.09 59.76 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 124.38 1.072 . . . . 0.0 113.208 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.19 110.97 5.48 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.211 1.004 . . . . 0.0 108.871 178.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -98.88 143.42 29.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.439 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.2 mp -118.75 136.19 24.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.67 159.44 52.71 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.931 2.421 . . . . 0.0 112.905 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -61.83 -27.75 68.99 Favored 'General case' 0 C--O 1.225 -0.224 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -71.77 -22.67 61.56 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.946 0.794 . . . . 0.0 110.093 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -84.47 -24.7 29.35 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -64.81 147.07 12.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -112.08 -60.97 1.78 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.602 1.161 . . . . 0.0 110.937 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -153.93 168.01 27.82 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.391 0.676 . . . . 0.0 112.486 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 p -69.87 147.57 50.13 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 126.12 1.768 . . . . 0.0 109.196 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -119.25 -52.6 2.28 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 117.791 -1.1 . . . . 0.0 111.404 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 t -149.11 118.59 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 119.787 1.176 . . . . 0.0 112.598 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 tttt -86.03 101.45 12.94 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 177.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -125.49 158.23 34.99 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 128.834 2.854 . . . . 0.0 107.39 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -141.12 108.16 5.45 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 120.21 1.368 . . . . 0.0 111.984 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.757 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -148.13 138.58 22.86 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.325 -0.859 . . . . 0.0 110.432 178.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -130.76 145.08 51.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 127.467 2.307 . . . . 0.0 108.15 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.757 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -150.24 171.34 17.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.394 1.877 . . . . 0.0 109.03 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.0 mt -128.22 131.93 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 124.433 1.093 . . . . 0.0 108.104 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.59 130.21 74.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.296 1.038 . . . . 0.0 111.01 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.63 122.61 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 127.244 2.217 . . . . 0.0 110.109 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.0 mmm -69.25 -21.8 63.88 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -83.07 -53.26 5.94 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.495 1.118 . . . . 0.0 110.991 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.3 m -92.4 -11.01 36.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.105 -178.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 60.89 23.43 13.48 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 120.073 1.306 . . . . 0.0 110.766 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 mtpp -110.98 162.7 14.58 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.944 1.298 . . . . 0.0 111.371 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.621 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -74.98 146.57 41.57 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.29 0.636 . . . . 0.0 110.88 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.5 mt -135.22 174.98 10.01 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.87 1.668 . . . . 0.0 109.761 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.9 m -115.09 -8.65 12.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.607 1.163 . . . . 0.0 110.455 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.6 m -116.92 127.11 53.92 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.569 1.148 . . . . 0.0 113.086 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 29.1 t -80.13 99.23 7.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -121.41 166.84 13.52 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.369 0.668 . . . . 0.0 109.984 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -56.5 -36.78 69.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -87.73 18.53 3.98 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 123.065 0.546 . . . . 0.0 110.401 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.8 t -138.37 154.46 48.94 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 126.173 1.789 . . . . 0.0 108.678 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.64 139.87 48.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.052 0.941 . . . . 0.0 109.194 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.71 144.37 26.04 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.938 0.895 . . . . 0.0 109.543 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -136.15 150.47 49.07 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.013 1.325 . . . . 0.0 107.519 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.5 t -125.37 103.35 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -86.29 95.26 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -160.59 -174.82 4.65 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 114.842 1.423 . . . . 0.0 114.842 -176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.81 68.95 0.48 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.73 2.012 . . . . 0.0 114.616 178.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.6 mt -68.9 145.36 13.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.679 1.192 . . . . 0.0 110.107 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -140.12 169.69 17.22 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 128.134 2.574 . . . . 0.0 110.414 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -115.78 163.68 15.48 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 127.781 2.432 . . . . 0.0 108.672 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -120.86 168.64 11.25 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.799 2.04 . . . . 0.0 109.994 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -57.3 -36.93 71.69 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -85.97 18.78 2.84 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.874 1.27 . . . . 0.0 111.403 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.0 mmtt 66.14 9.86 6.61 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.065 1.346 . . . . 0.0 112.261 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 t -73.92 137.92 43.95 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -100.18 150.46 22.49 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 122.974 0.51 . . . . 0.0 109.808 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.1 p -145.68 171.11 15.2 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.802 0.441 . . . . 0.0 112.117 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.9 ttm -137.18 142.17 42.17 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.1 1.76 . . . . 0.0 110.644 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.81 129.55 9.14 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 124.772 1.177 . . . . 0.0 110.824 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.9 mt -147.6 126.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 105.507 -2.035 . . . . 0.0 105.507 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 50.69 39.99 23.03 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.765 0.826 . . . . 0.0 110.396 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 63.54 15.55 8.93 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.975 2.11 . . . . 0.0 114.755 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -118.22 140.34 49.95 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 125.495 1.518 . . . . 0.0 107.388 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -91.33 116.15 28.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.903 -0.498 . . . . 0.0 110.81 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.28 127.25 53.38 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 124.975 1.31 . . . . 0.0 109.769 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.572 ' HE3' HD21 ' A' ' 94' ' ' LEU . 15.9 tttp -60.98 154.65 21.97 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.184 0.993 . . . . 0.0 110.216 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -120.24 132.66 69.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.572 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.1 mm? -120.42 155.47 56.36 Favored Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 124.486 1.114 . . . . 0.0 110.286 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.35 147.87 60.04 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.706 2.271 . . . . 0.0 107.864 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.11 -18.43 47.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.136 0.426 . . . . 0.0 111.919 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.6 t -67.51 -21.61 65.48 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 121.301 -0.875 . . . . 0.0 109.964 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -79.66 -3.11 45.79 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.119 0.968 . . . . 0.0 113.392 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -52.62 155.87 2.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.313 1.054 . . . . 0.0 109.571 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.85 -42.51 2.65 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.24 -32.47 24.44 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 p -137.7 162.37 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 C-N-CA 125.957 1.703 . . . . 0.0 108.955 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -136.31 170.61 15.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.922 2.489 . . . . 0.0 107.529 179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.11 166.24 2.95 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.797 0.808 . . . . 0.0 110.699 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.614 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -65.15 171.9 3.39 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.177 0.591 . . . . 0.0 111.558 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.614 ' N ' HD12 ' A' ' 105' ' ' LEU . 61.9 mtm180 -127.29 136.29 51.76 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.722 0.809 . . . . 0.0 111.162 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 107' ' ' LEU . 0.8 OUTLIER -67.32 -21.32 65.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 124.342 1.057 . . . . 0.0 112.2 -179.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -60.05 -10.85 4.72 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -81.9 -0.43 43.73 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.867 0.758 . . . . 0.0 109.81 177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.245 0.839 0 C-N-CA 127.579 2.352 . . . . 0.0 107.914 -179.454 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 . . . . . 0 CA--C 1.518 -0.263 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -99.54 -176.99 3.44 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.19 1.396 . . . . 0.0 108.326 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.6 p -132.85 69.76 1.48 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 p -67.92 65.78 0.09 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.564 2.346 . . . . 0.0 111.931 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -136.62 2.59 2.69 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.518 1.927 . . . . 0.0 112.458 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.4 145.26 24.78 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 120.908 -1.12 . . . . 0.0 109.39 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.74 167.25 7.66 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 127.882 2.473 . . . . 0.0 111.583 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.8 t -132.96 130.62 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.7 ttm-85 -102.6 115.83 31.36 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -86.81 166.77 14.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -75.19 -33.04 61.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.933 0.788 . . . . 0.0 112.104 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 60.41 117.73 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.297 1.839 . . . . 0.0 114.295 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.63 18.96 78.54 Favored Glycine 0 CA--C 1.531 1.053 0 N-CA-C 110.543 -1.023 . . . . 0.0 110.543 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -137.94 178.04 7.42 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.938 1.695 . . . . 0.0 111.184 -178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -74.18 -168.38 0.63 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 128.707 2.803 . . . . 0.0 108.937 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.4 p -79.12 120.16 23.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.436 2.065 . . . . 0.0 107.849 -176.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -168.64 145.76 3.84 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 130.353 3.461 . . . . 0.0 105.941 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 39.4 p90 -165.21 174.91 9.75 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.215 2.206 . . . . 0.0 106.771 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 73.2 mt -135.44 128.28 47.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -137.09 140.63 42.09 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.2 t70 51.83 39.19 25.16 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.9 1.68 . . . . 0.0 112.489 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.61 16.78 10.66 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.629 1.572 . . . . 0.0 112.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -120.2 141.87 49.52 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.872 1.269 . . . . 0.0 110.08 -178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.9 m -72.33 127.42 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.691 1.597 . . . . 0.0 108.706 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -140.39 160.03 40.89 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.565 0.746 . . . . 0.0 112.34 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -148.8 162.57 39.53 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 121.21 -0.931 . . . . 0.0 111.189 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.2 t -92.23 127.55 44.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 124.097 0.959 . . . . 0.0 109.894 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.8 p -98.97 171.13 8.24 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.817 1.247 . . . . 0.0 109.863 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -81.17 -10.9 59.56 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.998 1.719 . . . . 0.0 112.598 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.29 111.5 5.94 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.552 1.941 . . . . 0.0 109.692 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.8 tt0 -95.96 146.36 24.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.309 1.444 . . . . 0.0 111.864 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.6 mp -117.99 131.77 24.01 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.748 2.419 . . . . 0.0 107.253 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -73.95 156.28 47.82 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 123.591 2.86 . . . . 0.0 112.484 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -58.26 -26.6 63.12 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.085 0.954 . . . . 0.0 113.5 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.41 -26.21 63.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.317 0.508 . . . . 0.0 110.665 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -82.82 -25.33 32.79 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.56 118.2 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 124.014 0.925 . . . . 0.0 108.598 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -77.77 -61.04 2.12 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.049 0.94 . . . . 0.0 109.776 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -159.75 173.63 15.73 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.86 0.864 . . . . 0.0 109.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.423 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 70.0 m -62.91 171.36 2.2 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 125.024 1.33 . . . . 0.0 110.933 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -145.79 -45.03 0.21 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 120.559 -1.338 . . . . 0.0 113.746 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.2 t -152.44 132.88 4.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-N 118.983 0.811 . . . . 0.0 109.693 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -109.52 109.01 19.69 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 125.094 1.358 . . . . 0.0 107.782 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -139.39 157.41 45.92 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 127.894 2.478 . . . . 0.0 107.274 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -125.27 107.48 10.76 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.469 ' HE2' HD23 ' A' ' 49' ' ' LEU . 12.8 tptm -145.59 122.72 11.46 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.835 0.743 . . . . 0.0 109.332 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.4 tt -129.73 143.36 50.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 128.548 2.739 . . . . 0.0 106.575 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.469 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -152.23 170.54 19.77 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 126.047 1.739 . . . . 0.0 107.245 178.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.434 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.5 mt -129.22 132.02 67.25 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.1 t -121.98 136.16 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.047 1.339 . . . . 0.0 108.755 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -78.85 119.04 21.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 126.001 1.72 . . . . 0.0 109.301 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.9 mtp -68.44 -19.53 64.58 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 121.789 2.086 . . . . 0.0 111.531 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.2 -38.27 69.08 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 117.914 -1.041 . . . . 0.0 113.638 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.3 p -121.98 -9.06 8.79 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 60.31 41.19 16.74 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 125.969 1.707 . . . . 0.0 111.024 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -122.47 158.26 30.15 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.902 1.281 . . . . 0.0 109.491 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.434 HD13 ' O ' ' A' ' 50' ' ' ILE . 4.3 mm? -71.02 146.95 49.07 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.02 0.528 . . . . 0.0 111.734 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.6 mt -132.64 158.17 42.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.704 1.602 . . . . 0.0 110.3 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -86.75 -21.84 26.32 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.524 0.73 . . . . 0.0 110.726 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -135.95 146.79 47.65 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 125.462 1.505 . . . . 0.0 111.246 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.64 98.85 11.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 127.595 2.358 . . . . 0.0 112.03 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -97.08 171.76 8.27 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.8 -0.563 . . . . 0.0 110.155 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -53.61 -21.89 7.59 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.697 2.399 . . . . 0.0 117.462 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -105.73 1.17 26.86 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.578 1.951 . . . . 0.0 110.675 179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.7 t -114.69 161.83 17.62 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.974 1.71 . . . . 0.0 110.63 -177.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.2 t -138.55 126.46 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 124.612 1.165 . . . . 0.0 109.284 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.9 t -77.31 143.09 39.07 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.9 mt -130.21 145.41 51.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.38 103.69 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.26 93.03 6.66 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 -179.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.31 -162.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 44.17 67.28 0.7 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.699 1.999 . . . . 0.0 111.482 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 mt -75.14 142.64 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.427 1.091 . . . . 0.0 110.105 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 73.6 m-85 -141.87 158.6 43.59 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -103.03 165.5 10.99 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.718 1.207 . . . . 0.0 110.104 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.24 169.99 12.31 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.733 0.813 . . . . 0.0 112.736 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -58.78 -41.1 85.88 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.245 1.418 . . . . 0.0 109.814 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.03 13.24 5.22 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.579 1.951 . . . . 0.0 109.797 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.46 10.98 5.23 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.85 2.06 . . . . 0.0 110.922 -177.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.2 m -65.41 149.58 49.76 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -111.32 140.23 46.06 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.13 175.2 9.82 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.818 0.847 . . . . 0.0 112.086 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.8 ttm -134.83 142.14 46.57 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 126.9 2.08 . . . . 0.0 108.967 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.65 125.78 8.09 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.953 -1.659 . . . . 0.0 108.953 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.2 mt -142.6 121.53 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 48.35 54.94 9.59 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.254 1.421 . . . . 0.0 113.51 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 69.25 -2.84 1.71 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.88 1.672 . . . . 0.0 114.712 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -112.78 156.7 22.41 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 125.129 1.372 . . . . 0.0 109.469 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.69 117.0 29.6 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.14 0.976 . . . . 0.0 109.396 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.76 133.64 52.91 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.269 1.428 . . . . 0.0 112.175 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.482 ' HE3' HD21 ' A' ' 94' ' ' LEU . 13.2 ttpt -63.1 145.07 56.25 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.757 0.823 . . . . 0.0 110.877 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -110.36 132.63 58.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.482 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.4 mm? -126.46 156.32 73.07 Favored Pre-proline 0 N--CA 1.466 0.365 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.19 161.8 42.18 Favored 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 122.247 1.965 . . . . 0.0 111.057 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -21.25 66.46 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.56 -6.04 37.77 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.024 1.33 . . . . 0.0 112.579 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.33 -3.94 36.05 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.374 0.988 . . . . 0.0 111.69 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 20.1 mmtm -54.47 156.96 3.06 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-N 119.596 1.089 . . . . 0.0 111.873 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 108.49 -42.81 1.85 Allowed Glycine 0 CA--C 1.521 0.464 0 N-CA-C 108.396 -1.882 . . . . 0.0 108.396 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -94.37 -42.25 8.99 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.1 159.96 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 C-N-CA 125.617 1.567 . . . . 0.0 110.77 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -143.07 173.29 11.7 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.694 2.798 . . . . 0.0 107.0 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.6 164.88 4.18 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 124.655 1.182 . . . . 0.0 110.359 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 172.96 3.89 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -116.97 127.39 54.15 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 125.385 1.474 . . . . 0.0 108.655 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.5 OUTLIER -64.93 -20.17 66.32 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.578 0.751 . . . . 0.0 111.121 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -55.04 -24.86 26.91 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.54 1.536 . . . . 0.0 111.782 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -68.86 -16.0 63.65 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.495 -0.753 . . . . 0.0 110.416 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 125.999 1.72 . . . . 0.0 109.789 -178.98 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -133.15 178.87 6.57 Favored 'General case' 0 C--O 1.238 0.452 0 O-C-N 119.759 -1.838 . . . . 0.0 107.813 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.6 t -154.76 163.01 40.87 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.342 -0.849 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.9 t -111.25 90.48 3.35 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 126.217 1.807 . . . . 0.0 106.255 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -57.41 122.41 12.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.541 1.136 . . . . 0.0 108.927 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -139.31 168.18 20.42 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.003 1.321 . . . . 0.0 110.373 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -65.12 133.71 52.17 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 178.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.43 135.89 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.1 ttt-85 -107.91 98.52 8.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -82.24 148.92 28.13 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.55 -33.73 73.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 117.885 -1.055 . . . . 0.0 112.686 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 79.06 131.07 0.05 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 129.7 3.2 . . . . 0.0 114.281 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.41 34.49 54.64 Favored Glycine 0 CA--C 1.522 0.501 0 C-N-CA 126.088 1.804 . . . . 0.0 111.196 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.9 p -137.83 178.48 7.08 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 110.575 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.78 -170.08 0.65 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.891 2.076 . . . . 0.0 109.328 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.3 p -79.6 120.22 23.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 123.927 1.822 . . . . 0.0 108.535 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -167.44 149.95 5.98 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 130.976 3.71 . . . . 0.0 105.014 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.432 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 42.7 p90 -172.88 175.86 3.22 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 19.4 mt -134.56 130.94 53.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -130.61 138.15 49.97 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.6 t0 47.57 42.97 15.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.747 1.619 . . . . 0.0 113.832 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 61.0 22.51 12.75 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 0.0 112.877 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -122.9 128.64 50.6 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 126.222 1.809 . . . . 0.0 106.623 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 71.2 m -74.75 132.25 41.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 6.6 m-85 -130.35 166.28 20.75 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 127.013 2.125 . . . . 0.0 110.348 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -148.54 166.35 28.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 t -99.63 126.93 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.2 p -93.26 171.18 9.08 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.896 0.878 . . . . 0.0 110.291 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -77.86 -15.67 58.87 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.463 1.505 . . . . 0.0 111.53 177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -66.8 122.77 18.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.991 1.317 . . . . 0.0 110.618 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 32.6 tt0 -111.0 145.68 38.02 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.227 1.411 . . . . 0.0 110.394 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -115.64 141.23 27.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 124.651 1.18 . . . . 0.0 108.654 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.99 152.15 51.19 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.208 2.605 . . . . 0.0 110.352 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.55 -33.04 63.5 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.49 ' HG3' HD22 ' A' ' 37' ' ' ASN . 9.4 pt-20 -64.56 -20.8 66.46 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.49 HD22 ' HG3' ' A' ' 36' ' ' GLU . 2.3 m-80 -90.97 -15.38 29.81 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.926 -0.559 . . . . 0.0 110.566 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.2 t -70.9 123.75 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.906 0.882 . . . . 0.0 108.623 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -62.04 1.72 Allowed 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.87 173.01 14.27 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 119.135 0.88 . . . . 0.0 110.825 178.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.5 p -65.34 135.78 55.72 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 125.49 1.516 . . . . 0.0 110.206 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.98 -49.39 3.14 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 116.996 -1.478 . . . . 0.0 112.656 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.8 t -143.92 122.01 6.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 120.185 1.357 . . . . 0.0 112.052 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm -83.05 114.31 21.2 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.11 158.84 44.58 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 127.828 2.451 . . . . 0.0 109.623 -178.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -143.44 119.75 10.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.011 0.924 . . . . 0.0 109.434 178.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' HE3' HD23 ' A' ' 49' ' ' LEU . 3.0 tmtm? -148.08 136.61 21.57 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -133.59 144.71 49.46 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.338 1.855 . . . . 0.0 109.072 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.438 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -156.3 169.67 24.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.016 1.327 . . . . 0.0 109.551 177.732 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.9 mt -126.43 136.0 62.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 125.492 1.517 . . . . 0.0 107.898 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.2 t -134.82 134.25 53.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 125.911 1.684 . . . . 0.0 109.991 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -72.13 116.81 12.99 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 127.917 2.487 . . . . 0.0 111.699 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 77.7 mtp -68.24 -18.28 64.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.128 0.876 . . . . 0.0 112.176 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -66.43 -53.78 31.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.818 1.19 . . . . 0.0 111.372 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.7 m -122.6 8.61 9.53 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 59.44 47.09 11.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.227 1.811 . . . . 0.0 112.939 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -116.64 147.17 42.17 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.368 1.067 . . . . 0.0 108.883 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mp -69.52 155.8 39.9 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.644 ' CD1' HD21 ' A' ' 63' ' ' ASN . 86.8 mt -135.36 157.81 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 124.723 1.209 . . . . 0.0 110.465 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.9 p -88.1 -12.44 44.13 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 117.285 -1.34 . . . . 0.0 114.194 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 p -147.66 148.99 31.64 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 121.136 1.789 . . . . 0.0 112.31 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -69.77 116.97 10.77 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.862 1.265 . . . . 0.0 109.393 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.644 HD21 ' CD1' ' A' ' 59' ' ' LEU . 4.4 p30 -137.43 156.64 47.94 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.18 1.392 . . . . 0.0 109.806 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -54.44 -31.64 55.84 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -80.39 3.57 20.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.322 0.965 . . . . 0.0 111.311 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -124.47 177.01 6.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.934 1.694 . . . . 0.0 111.616 -177.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.0 t -142.46 150.28 18.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 127.959 2.503 . . . . 0.0 105.831 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.8 t -102.61 140.63 36.63 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 106.895 -1.521 . . . . 0.0 106.895 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.9 mt -125.32 144.84 50.3 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.2 t -115.9 103.32 15.0 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.279 0 N-CA-C 104.324 -2.472 . . . . 0.0 104.324 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.87 94.37 8.9 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.361 -1.462 . . . . 0.0 107.39 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.25 -173.76 3.25 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -177.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 46.45 69.46 0.48 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 126.335 1.854 . . . . 0.0 114.815 177.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.3 mt -70.01 143.87 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -137.53 169.39 17.87 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 126.775 2.03 . . . . 0.0 108.833 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -117.96 154.13 32.46 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.28 161.07 16.4 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.526 1.13 . . . . 0.0 110.009 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -65.78 -13.36 59.27 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.274 0.63 . . . . 0.0 111.421 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 2.89 56.41 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.224 1.41 . . . . 0.0 109.472 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm 79.6 -1.59 2.16 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 129.157 2.983 . . . . 0.0 112.11 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.5 m -77.35 162.38 27.32 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 120.55 1.523 . . . . 0.0 108.099 178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.17 158.43 17.44 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.224 1.01 . . . . 0.0 109.639 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 31.3 p -149.32 172.79 14.32 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.037 0.835 . . . . 0.0 109.522 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.3 ttm -136.03 135.85 39.77 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.789 1.636 . . . . 0.0 108.449 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.26 109.88 3.12 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 74.9 mt -123.03 123.81 68.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.295 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.9 m120 51.7 37.91 21.41 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.794 1.237 . . . . 0.0 109.609 -179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 69.24 16.31 8.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 128.89 2.876 . . . . 0.0 114.554 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -117.17 132.75 56.58 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -86.5 115.92 24.3 Favored 'General case' 0 C--N 1.332 -0.179 0 O-C-N 121.569 -0.707 . . . . 0.0 110.252 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 32' ' ' GLU . 76.4 m-85 -110.21 128.27 55.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.861 1.265 . . . . 0.0 111.295 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.94 144.63 52.76 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.037 0.935 . . . . 0.0 110.315 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.57 132.91 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.36 156.48 57.78 Favored Pre-proline 0 N--CA 1.467 0.384 0 C-N-CA 124.457 1.103 . . . . 0.0 108.658 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -75.12 156.41 42.47 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.23 1.953 . . . . 0.0 108.505 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -65.5 -11.18 41.03 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.464 -0.773 . . . . 0.0 110.958 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -21.93 63.81 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.166 -0.959 . . . . 0.0 109.503 177.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.9 -7.39 59.6 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.483 1.113 . . . . 0.0 111.823 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -56.07 149.33 15.84 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 107.87 -32.05 7.43 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -178.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -115.97 -8.97 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.416 1.486 . . . . 0.0 111.887 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -150.54 150.2 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 C-N-CA 126.404 1.882 . . . . 0.0 107.13 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -131.06 169.67 15.55 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.765 1.626 . . . . 0.0 107.994 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.65 163.4 11.44 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.126 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.35 167.65 10.16 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt85 -110.36 135.67 50.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 126.148 1.779 . . . . 0.0 110.753 -178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -68.77 -15.58 63.55 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -59.03 -23.02 61.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.186 1.794 . . . . 0.0 111.441 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.5 m-20 -73.57 -6.02 43.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 118.341 -0.837 . . . . 0.0 111.981 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.565 1.546 . . . . 0.0 111.755 -177.822 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -109.05 131.15 55.35 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.76 -53.77 9.55 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.77 1.628 . . . . 0.0 113.157 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.9 t -52.33 124.54 13.56 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 126.684 1.993 . . . . 0.0 113.751 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -135.66 129.88 33.44 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 126.788 2.035 . . . . 0.0 108.16 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -147.4 156.39 42.83 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.097 2.159 . . . . 0.0 108.396 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -60.66 163.52 5.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.539 1.063 . . . . 0.0 110.161 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.3 t -110.12 130.55 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -89.15 116.97 27.8 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -85.08 153.3 22.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -59.66 -34.34 72.71 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 128.109 2.564 . . . . 0.0 113.96 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 59.66 103.64 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 127.944 2.498 . . . . 0.0 113.704 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' HA2' ' CD2' ' A' ' 58' ' ' LEU . . . 69.93 31.84 69.84 Favored Glycine 0 CA--C 1.528 0.88 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.279 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -134.71 179.88 6.02 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.397 1.879 . . . . 0.0 112.659 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.53 -168.59 0.45 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 128.155 2.582 . . . . 0.0 107.502 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -78.46 120.37 23.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 116.993 -1.883 . . . . 0.0 108.295 -175.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -168.06 146.68 4.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 128.949 2.899 . . . . 0.0 107.808 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -170.87 177.05 3.92 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.321 0.964 . . . . 0.0 109.429 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 44.1 mt -135.65 126.28 43.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 O-C-N 121.446 -0.784 . . . . 0.0 109.031 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -129.86 134.24 47.4 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 105.576 -2.009 . . . . 0.0 105.576 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.8 t0 53.15 38.09 26.64 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.255 1.022 . . . . 0.0 112.49 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 m120 62.57 16.02 8.43 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.482 2.313 . . . . 0.0 113.112 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.4 mtpp -111.4 136.95 49.82 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.46 1.104 . . . . 0.0 108.796 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -71.55 122.24 20.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.449 1.5 . . . . 0.0 107.611 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -134.48 162.33 32.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.181 1.393 . . . . 0.0 109.957 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -149.27 171.89 15.76 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 124.397 1.079 . . . . 0.0 108.527 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 t -100.82 125.26 54.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.5 p -96.52 170.47 9.19 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.521 1.129 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -77.72 -9.44 59.0 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.185 1.794 . . . . 0.0 112.961 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -70.19 97.46 1.21 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.858 1.263 . . . . 0.0 108.523 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -89.14 145.1 25.65 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 123.655 0.782 . . . . 0.0 109.672 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -119.95 142.77 33.91 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 126.514 1.926 . . . . 0.0 112.399 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.79 146.82 30.35 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 123.836 3.024 . . . . 0.0 109.728 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -53.99 -31.52 51.2 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.741 1.216 . . . . 0.0 113.874 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.72 -29.06 69.53 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.317 -0.864 . . . . 0.0 111.1 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -84.58 -15.46 45.57 Favored 'General case' 0 C--O 1.23 0.053 0 O-C-N 121.157 -0.964 . . . . 0.0 109.109 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 ' CD2' ' A' ' 90' ' ' TYR . 95.4 t -77.18 114.04 17.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 178.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.484 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.1 OUTLIER -68.09 -61.26 1.94 Allowed 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 124.915 1.286 . . . . 0.0 109.5 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.2 169.47 20.71 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.402 1.001 . . . . 0.0 110.502 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 p -71.58 151.72 43.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.47 ' HD2' HD12 ' A' ' 82' ' ' LEU . 3.8 ttmt -118.58 -38.78 3.08 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.492 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 t -147.57 140.87 19.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 118.548 0.613 . . . . 0.0 111.905 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -113.88 93.95 4.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 125.596 1.558 . . . . 0.0 107.875 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -140.24 156.46 46.48 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 128.35 2.66 . . . . 0.0 105.549 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -131.01 126.49 36.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.291 1.836 . . . . 0.0 108.709 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE3' HD23 ' A' ' 71' ' ' LEU . 0.6 OUTLIER -147.37 129.99 15.96 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 178.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.4 tt -134.55 144.51 48.03 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 125.977 1.711 . . . . 0.0 108.175 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.45 169.88 23.6 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 125.918 1.687 . . . . 0.0 107.8 178.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.7 mt -128.01 134.71 64.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 119.56 1.073 . . . . 0.0 108.343 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.63 133.68 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 C-N-CA 125.061 1.344 . . . . 0.0 110.617 -178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -71.69 119.3 15.65 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.858 2.063 . . . . 0.0 108.506 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.1 mtp -68.72 -17.34 64.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.871 0.76 . . . . 0.0 112.684 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 7.4 mmpt? -79.81 -53.93 6.32 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.302 1.41 . . . . 0.0 112.47 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.6 m -97.31 -7.72 31.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 66.31 14.91 9.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.018 1.727 . . . . 0.0 110.846 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -99.11 155.25 17.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 125.631 1.572 . . . . 0.0 111.454 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.409 ' CD2' ' HA2' ' A' ' 14' ' ' GLY . 5.5 mp -74.0 157.46 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 177.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.7 mt -126.68 -174.4 3.12 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.794 1.238 . . . . 0.0 112.091 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.5 -13.77 15.92 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.465 1.906 . . . . 0.0 113.525 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 p -149.37 -172.41 4.13 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.615 1.166 . . . . 0.0 108.505 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.5 t -113.86 106.82 14.9 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -109.41 164.41 12.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 125.187 1.395 . . . . 0.0 109.061 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -10.96 6.04 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.682 1.593 . . . . 0.0 114.732 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.03 14.71 20.81 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.583 1.083 . . . . 0.0 109.001 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 t -131.87 167.18 20.04 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.51 1.524 . . . . 0.0 109.898 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 76.4 t -140.87 135.23 33.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 125.215 1.406 . . . . 0.0 109.0 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 t -79.43 142.9 35.5 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.8 mt -132.85 133.16 42.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.7 t -113.16 103.44 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 103.228 -2.879 . . . . 0.0 103.228 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.504 HD23 ' HE3' ' A' ' 47' ' ' LYS . 1.9 mm? -97.93 91.89 5.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 -178.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.87 -163.76 0.74 Allowed 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -176.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 54.13 67.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.963 0.887 . . . . 0.0 112.109 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.7 mt -80.79 133.71 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 O-C-N 121.346 -0.846 . . . . 0.0 110.239 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -133.39 169.71 16.54 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.566 1.946 . . . . 0.0 110.093 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -117.66 150.31 39.26 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 126.881 2.072 . . . . 0.0 109.745 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.99 168.49 9.02 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 126.86 2.064 . . . . 0.0 110.214 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.5 m -53.85 -37.95 64.17 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.242 1.017 . . . . 0.0 113.449 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -85.76 11.91 10.1 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 126.136 1.775 . . . . 0.0 113.211 -177.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.7 mptt 74.73 1.21 3.75 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.921 1.689 . . . . 0.0 110.223 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.8 t -71.21 152.33 43.45 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 104.821 -2.288 . . . . 0.0 104.821 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -109.28 153.17 24.25 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.628 0.771 . . . . 0.0 109.744 -178.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 25.6 p -139.62 168.33 20.06 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.517 1.127 . . . . 0.0 109.647 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.9 ttm -133.83 138.35 45.6 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.075 1.75 . . . . 0.0 109.703 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.27 118.84 4.71 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 127.279 2.371 . . . . 0.0 111.184 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.7 mt -137.0 119.66 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 51.48 44.21 29.15 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.625 0.77 . . . . 0.0 109.264 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 56.6 m-20 62.41 17.83 9.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.054 2.142 . . . . 0.0 114.676 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -118.48 131.27 56.25 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 124.371 1.068 . . . . 0.0 109.113 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.409 ' CD2' HG21 ' A' ' 38' ' ' VAL . 14.2 m-85 -86.74 116.29 24.74 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 122.338 0.255 . . . . 0.0 111.031 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -109.08 123.63 49.48 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.272 2.229 . . . . 0.0 109.547 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 15.7 ttpt -59.92 142.38 53.77 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.725 1.61 . . . . 0.0 111.289 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -110.45 133.66 55.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -129.36 163.42 46.45 Favored Pre-proline 0 N--CA 1.468 0.459 0 C-N-CA 125.886 1.675 . . . . 0.0 110.999 -177.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.59 152.22 37.82 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.68 2.253 . . . . 0.0 111.084 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -63.4 -6.34 4.72 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -15.44 59.69 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.63 -1.293 . . . . 0.0 110.929 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -73.01 -4.25 31.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 49.1 mttt -45.71 138.76 4.45 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 127.15 2.18 . . . . 0.0 111.06 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 101.77 -26.81 23.1 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.92 -18.62 8.16 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.402 1.081 . . . . 0.0 111.985 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -140.74 157.11 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -145.93 167.44 23.28 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 127.039 2.135 . . . . 0.0 107.767 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.18 162.46 5.86 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.258 0.623 . . . . 0.0 110.561 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.98 168.64 13.3 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.891 -0.506 . . . . 0.0 111.502 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -111.7 139.72 46.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.972 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.3 mp -68.82 -13.35 62.36 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 123.836 0.854 . . . . 0.0 111.019 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -60.27 -23.04 63.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.174 0.99 . . . . 0.0 111.943 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 14.7 m-20 -71.47 -7.48 47.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.341 1.056 . . . . 0.0 110.99 -177.114 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 14.8 p90 . . . . . 0 N--CA 1.471 0.602 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 51.39 32.32 8.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.02 1.328 . . . . 0.0 111.799 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.4 p -71.27 171.06 11.77 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.522 1.929 . . . . 0.0 111.896 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.0 m -146.54 -31.71 0.34 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.555 1.542 . . . . 0.0 112.099 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.8 t60 53.83 15.87 0.92 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.515 1.526 . . . . 0.0 112.757 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -62.07 134.61 56.82 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.739 1.616 . . . . 0.0 109.624 -179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.48 157.59 37.76 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.734 1.213 . . . . 0.0 108.984 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.403 HG21 HD12 ' A' ' 74' ' ' ILE . 84.8 t -112.23 144.7 19.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -119.44 96.93 5.41 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -76.22 155.09 34.74 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.197 -2.149 . . . . 0.0 105.197 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -62.39 -33.33 74.55 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 74.41 123.95 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.919 2.088 . . . . 0.0 110.431 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.83 35.07 38.5 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.466 1.031 . . . . 0.0 113.533 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -140.17 -179.65 6.1 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 128.172 2.589 . . . . 0.0 109.335 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -72.67 -168.35 0.44 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.287 2.235 . . . . 0.0 111.27 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.277 22.0 p -79.21 118.18 20.91 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -176.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -169.28 140.5 2.36 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 126.781 2.032 . . . . 0.0 108.218 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.478 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.9 p90 -160.68 169.61 22.49 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.22 126.65 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 107.661 -1.236 . . . . 0.0 107.661 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -138.43 136.1 35.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.2 t0 55.16 41.39 31.59 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.011 1.325 . . . . 0.0 112.271 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 59.77 28.16 17.58 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.507 1.523 . . . . 0.0 111.644 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -130.95 142.76 50.38 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.403 1.081 . . . . 0.0 110.993 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.1 m -70.19 126.59 30.11 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.366 1.866 . . . . 0.0 107.767 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.478 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 5.5 m-85 -137.57 160.23 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.996 0.918 . . . . 0.0 110.397 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.46 ' CE2' HG22 ' A' ' 29' ' ' THR . 21.8 p90 -149.63 165.29 32.73 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.998 0.919 . . . . 0.0 109.007 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.489 HG22 HG22 ' A' ' 93' ' ' ILE . 41.5 t -94.65 128.64 45.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.916 -0.49 . . . . 0.0 109.779 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 27' ' ' PHE . 17.6 p -96.27 166.47 11.71 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.001 1.32 . . . . 0.0 111.962 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -76.87 -10.03 59.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.021 1.328 . . . . 0.0 112.443 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -71.69 98.94 2.02 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.396 1.479 . . . . 0.0 108.038 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -89.98 142.92 27.24 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.7 mp -115.12 140.87 26.2 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 125.963 1.705 . . . . 0.0 107.966 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.26 149.18 50.91 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.247 1.965 . . . . 0.0 109.909 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -57.71 -23.55 52.35 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -73.14 -23.67 60.5 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.931 -0.481 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.47 -14.82 39.4 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.654 1.182 . . . . 0.0 109.976 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.98 122.73 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -73.21 -61.51 1.79 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.09 168.35 13.72 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.931 1.292 . . . . 0.0 110.569 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.1 p -65.14 160.36 21.41 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HE3' HD12 ' A' ' 82' ' ' LEU . 20.5 ttmm -128.21 -50.01 1.31 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 117.492 -1.242 . . . . 0.0 111.347 178.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -143.2 136.65 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 120.021 1.282 . . . . 0.0 111.691 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 mtmm -104.24 114.83 29.34 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.613 1.965 . . . . 0.0 109.201 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -146.8 157.91 43.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 127.613 2.365 . . . . 0.0 108.988 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 108.29 5.65 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.274 0.943 . . . . 0.0 110.58 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.19 142.24 27.08 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.8 tt -135.15 145.27 47.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 127.979 2.512 . . . . 0.0 109.382 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.48 170.37 17.0 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.89 1.676 . . . . 0.0 108.755 178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.98 136.73 59.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 C-N-CA 125.49 1.516 . . . . 0.0 108.621 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -137.19 134.77 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.285 0.634 . . . . 0.0 109.956 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.587 ' HB2' HD11 ' A' ' 59' ' ' LEU . 11.4 t0 -79.81 125.35 29.59 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.403 1.081 . . . . 0.0 108.458 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 81.7 mtp -65.94 -16.22 63.67 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.965 1.257 . . . . 0.0 112.934 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -63.36 -53.79 47.03 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.094 0.861 . . . . 0.0 111.719 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.3 t -122.69 9.44 9.54 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 56.53 38.21 29.45 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.767 1.167 . . . . 0.0 110.085 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -105.86 143.03 34.58 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 125.223 1.409 . . . . 0.0 108.676 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.72 153.72 41.03 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.819 0.818 . . . . 0.0 111.092 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.587 HD11 ' HB2' ' A' ' 52' ' ' ASP . 31.7 mt -135.25 157.6 46.49 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.629 -1.168 . . . . 0.0 110.803 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.24 -20.88 33.7 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.815 1.246 . . . . 0.0 110.973 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 m -149.22 140.32 23.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.077 0.951 . . . . 0.0 108.454 -178.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.64 119.0 19.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.551 1.54 . . . . 0.0 110.404 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -107.28 172.0 7.07 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 126.329 1.852 . . . . 0.0 107.438 177.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -56.74 -26.45 57.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.717 1.376 . . . . 0.0 114.717 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -92.86 4.17 54.36 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.491 0.716 . . . . 0.0 111.754 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 43.0 t -117.62 166.69 12.1 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.569 1.548 . . . . 0.0 113.314 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.5 t -137.53 148.25 25.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 C-N-CA 127.046 2.139 . . . . 0.0 106.545 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -101.91 143.4 31.85 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -130.86 136.82 49.0 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.6 t -116.04 101.96 12.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.72 96.7 9.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.915 1.286 . . . . 0.0 107.957 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -170.58 -161.76 0.25 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 118.41 0.55 . . . . 0.0 112.398 -178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 52.42 66.76 1.12 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.639 1.976 . . . . 0.0 112.281 176.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.403 HD12 HG21 ' A' ' 9' ' ' VAL . 2.3 mt -81.55 135.12 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.184 -0.948 . . . . 0.0 111.277 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -139.36 161.97 36.15 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 126.637 1.975 . . . . 0.0 109.729 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -104.67 155.43 18.87 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.517 1.527 . . . . 0.0 108.606 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.59 163.92 12.82 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.419 1.887 . . . . 0.0 109.75 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.1 p -57.76 -34.2 69.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.378 0.671 . . . . 0.0 112.809 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -80.55 11.63 3.62 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.038 0.935 . . . . 0.0 110.582 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 71.19 12.04 6.83 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 127.878 2.471 . . . . 0.0 110.29 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.13 167.14 20.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.433 HD12 ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -119.12 148.4 43.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.637 1.175 . . . . 0.0 109.553 -178.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 17.5 p -147.2 167.23 24.72 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.476 0.71 . . . . 0.0 110.161 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 43.4 ttm -133.85 137.55 45.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 126.313 1.845 . . . . 0.0 108.198 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.54 121.2 5.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 125.298 1.428 . . . . 0.0 109.82 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.0 mt -136.72 120.62 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 51.42 51.22 17.26 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.586 1.954 . . . . 0.0 110.103 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t0 59.86 15.89 5.26 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.015 1.726 . . . . 0.0 114.134 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -121.09 139.18 53.67 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 125.266 1.426 . . . . 0.0 109.389 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -96.72 116.43 29.12 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 118.331 0.514 . . . . 0.0 111.391 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -106.89 125.84 51.53 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 125.26 1.424 . . . . 0.0 109.491 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -60.71 146.32 46.22 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 124.155 0.982 . . . . 0.0 109.697 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.489 HG22 HG22 ' A' ' 28' ' ' VAL . 1.3 pt -115.9 132.93 63.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -129.19 165.16 34.34 Favored Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 124.713 1.205 . . . . 0.0 112.33 -177.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.96 148.81 32.14 Favored 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 122.819 2.346 . . . . 0.0 110.176 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -58.65 -15.32 11.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.404 0.682 . . . . 0.0 112.703 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.2 m -72.66 -14.91 61.69 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 120.762 -1.211 . . . . 0.0 112.055 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.42 -4.07 43.48 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.799 -1.188 . . . . 0.0 111.445 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -53.96 150.24 8.07 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.994 1.318 . . . . 0.0 108.941 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 94.6 1.81 63.7 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -148.86 -49.89 0.15 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.018 2.527 . . . . 0.0 106.259 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 t -109.3 161.51 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.152 0.981 . . . . 0.0 109.068 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -150.67 170.51 19.01 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 127.097 2.159 . . . . 0.0 108.864 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.62 169.11 2.54 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.203 1.001 . . . . 0.0 112.174 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.31 174.94 9.57 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.587 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.1 mtt85 -125.12 141.69 51.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 O-C-N 121.887 -0.508 . . . . 0.0 110.79 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.579 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.4 OUTLIER -63.12 -22.04 66.59 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 124.312 1.045 . . . . 0.0 110.936 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -57.29 -16.57 8.92 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -76.77 -3.11 36.52 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.336 0.655 . . . . 0.0 110.495 178.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 C--O 1.253 1.252 0 C-N-CA 127.719 2.408 . . . . 0.0 107.729 -178.987 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 30.8 t80 . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -91.12 167.48 12.33 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.217 1.372 . . . . 0.0 109.958 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.6 p -138.24 -13.82 1.35 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.105 1.362 . . . . 0.0 112.573 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.8 m -81.38 151.8 27.77 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.71 1.204 . . . . 0.0 110.457 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -135.05 158.42 44.4 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.985 1.714 . . . . 0.0 106.664 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -139.36 153.76 47.73 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.093 1.357 . . . . 0.0 108.668 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? -67.54 137.23 55.58 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -104.07 130.45 54.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -98.23 111.94 24.09 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -87.04 158.88 19.13 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.85 -33.93 75.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 75.2 128.11 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.352 2.261 . . . . 0.0 112.348 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 51.99 34.83 39.32 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 125.737 1.637 . . . . 0.0 112.249 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.9 m -139.89 178.47 7.23 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 125.928 1.691 . . . . 0.0 112.096 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -73.65 -169.45 0.7 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.116 1.767 . . . . 0.0 108.764 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.6 p -79.67 120.88 24.59 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 119.658 -1.901 . . . . 0.0 110.574 -175.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -168.23 144.41 3.84 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 130.172 3.389 . . . . 0.0 106.596 178.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 31.7 p90 -165.79 165.43 18.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.5 mp -120.57 131.3 73.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 123.784 0.834 . . . . 0.0 109.148 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -144.45 143.91 31.12 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 105.466 -2.05 . . . . 0.0 105.466 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 50.64 34.31 9.56 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 112.638 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 58.01 33.52 23.28 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 112.384 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mtpp -130.61 146.3 52.09 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.062 1.745 . . . . 0.0 106.864 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 m -74.44 140.81 44.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.8 m-85 -139.54 159.23 42.65 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 125.643 1.577 . . . . 0.0 109.523 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -148.91 165.69 30.8 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.021 -1.05 . . . . 0.0 109.799 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.9 t -101.26 128.24 53.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 p -99.71 172.39 7.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.356 1.462 . . . . 0.0 109.05 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -78.05 -15.58 58.79 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.624 1.97 . . . . 0.0 112.273 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -67.31 116.33 7.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.514 1.126 . . . . 0.0 110.681 -179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.24 148.26 23.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 125.969 1.708 . . . . 0.0 111.47 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.489 HD11 ' CD ' ' A' ' 92' ' ' LYS . 23.6 mm -116.4 127.77 26.5 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 126.594 1.958 . . . . 0.0 109.419 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.63 146.74 68.25 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.7 2.267 . . . . 0.0 109.477 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -55.93 -27.64 53.2 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.6 -23.78 67.52 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.535 0.734 . . . . 0.0 111.574 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -95.12 -19.07 20.41 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -64.63 139.21 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.438 ' ND2' HD22 ' A' ' 40' ' ' ASN . 0.2 OUTLIER -93.36 -60.94 1.66 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.258 -179.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.438 HD22 ' ND2' ' A' ' 39' ' ' ASN . 6.7 p30 -163.43 166.04 23.22 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.65 0.78 . . . . 0.0 111.668 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 p -70.76 126.74 30.42 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -101.51 -42.16 6.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 55.3 t -142.64 127.95 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 119.105 0.866 . . . . 0.0 108.877 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -100.38 117.37 34.43 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 178.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -149.93 157.08 42.82 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 131.282 3.833 . . . . 0.0 105.197 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -137.21 115.39 11.67 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 104.052 -2.574 . . . . 0.0 104.052 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -146.77 133.52 20.01 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.6 tt -137.58 145.63 43.08 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.876 1.67 . . . . 0.0 108.215 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.88 169.31 25.06 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 125.909 1.683 . . . . 0.0 106.48 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.5 mt -127.97 137.41 57.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 C-N-CA 125.617 1.567 . . . . 0.0 107.111 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -130.55 140.22 49.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -83.71 126.98 33.43 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 84.2 mtp -67.62 -18.69 65.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -72.22 -44.61 62.67 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.8 m -122.13 0.84 9.68 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.61 30.28 18.56 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.885 1.274 . . . . 0.0 111.068 -179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -99.05 147.05 25.43 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.88 0.872 . . . . 0.0 110.0 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.91 146.95 43.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mp -124.43 177.58 5.83 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.379 1.472 . . . . 0.0 110.397 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 t -116.9 -3.25 11.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.978 1.311 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 p -144.7 162.34 36.96 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 120.219 1.372 . . . . 0.0 109.129 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.8 t -92.76 115.4 28.08 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -124.44 161.59 25.71 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -56.45 -19.93 17.49 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -93.08 -4.33 52.58 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.92 0.888 . . . . 0.0 110.753 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 m -113.7 160.09 19.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.484 1.514 . . . . 0.0 113.771 -176.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 25.3 t -137.07 146.59 27.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 125.191 1.397 . . . . 0.0 108.826 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -85.75 141.37 29.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.8 mt -129.98 100.75 5.56 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 105.887 -1.894 . . . . 0.0 105.887 179.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.87 102.41 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 103.203 -2.888 . . . . 0.0 103.203 179.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -93.32 93.71 8.35 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.37 -167.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.656 -0.418 . . . . 0.0 112.005 -176.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 47.1 67.38 0.8 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.012 1.725 . . . . 0.0 111.723 177.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.2 mt -77.45 140.12 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.538 -1.351 . . . . 0.0 109.591 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -134.15 169.67 16.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.753 2.021 . . . . 0.0 111.01 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -113.06 170.8 7.95 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.017 2.127 . . . . 0.0 109.601 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.61 161.24 26.67 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.747 2.019 . . . . 0.0 108.272 179.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.1 t -60.57 -26.88 67.27 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.504 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -93.53 28.49 2.27 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.49 1.916 . . . . 0.0 111.32 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 59.35 3.19 0.36 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.328 1.851 . . . . 0.0 112.93 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.7 m -73.49 152.86 40.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -114.49 150.09 35.37 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.297 0.639 . . . . 0.0 110.773 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.0 p -144.69 169.44 18.0 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.901 0.88 . . . . 0.0 110.619 178.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.0 ttm -134.46 136.24 43.06 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 126.391 1.876 . . . . 0.0 109.328 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.48 110.38 3.28 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 125.502 1.525 . . . . 0.0 111.439 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 73.2 mt -123.68 119.16 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 49.49 51.81 15.69 Favored 'General case' 0 C--O 1.23 0.076 0 C-N-CA 124.689 1.195 . . . . 0.0 109.903 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 70.31 -6.22 1.2 Allowed 'General case' 0 C--O 1.24 0.561 0 C-N-CA 128.046 2.538 . . . . 0.0 115.525 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -105.41 133.74 49.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 120.396 1.453 . . . . 0.0 110.646 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -85.67 116.66 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.455 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -115.85 132.53 56.61 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.504 1.122 . . . . 0.0 112.219 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.587 ' HE3' HD21 ' A' ' 94' ' ' LEU . 2.2 mtpp -60.53 142.38 55.41 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.833 1.253 . . . . 0.0 111.19 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.7 135.5 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.587 HD21 ' HE3' ' A' ' 92' ' ' LYS . 4.0 mm? -130.18 159.3 71.01 Favored Pre-proline 0 C--O 1.237 0.397 0 C-N-CA 123.954 0.902 . . . . 0.0 108.818 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.0 161.18 45.32 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.312 2.008 . . . . 0.0 109.831 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.17 -13.07 32.77 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 110.472 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -63.34 -24.36 67.82 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.216 1.806 . . . . 0.0 109.555 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.47 -10.69 59.99 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.828 1.251 . . . . 0.0 111.183 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.9 mmtt -59.26 161.49 5.42 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 120.682 -1.261 . . . . 0.0 109.941 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.7 -35.11 4.18 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -124.15 -5.92 7.81 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.3 t -135.51 156.81 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 126.515 1.926 . . . . 0.0 105.863 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -138.6 165.45 26.87 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.892 1.677 . . . . 0.0 108.131 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.88 166.42 15.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.02 167.31 10.04 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -106.89 132.29 53.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 125.886 1.674 . . . . 0.0 110.474 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.1 mt -67.38 -21.41 65.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.311 0.644 . . . . 0.0 109.984 178.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -60.07 -20.42 58.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.816 -0.611 . . . . 0.0 111.901 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -67.09 -16.93 64.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.97 0.804 . . . . 0.0 112.293 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.691 1.996 . . . . 0.0 111.33 -177.387 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -130.32 151.6 50.65 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.202 0.601 . . . . 0.0 109.925 179.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.8 t -128.24 -6.9 5.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.71 166.7 5.16 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-N 118.943 0.792 . . . . 0.0 109.539 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -49.31 156.17 0.62 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -127.86 8.58 6.28 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.433 1.493 . . . . 0.0 111.832 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -60.13 128.16 35.44 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.7 t -64.44 143.71 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 O-C-N 121.825 -0.547 . . . . 0.0 110.183 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -117.12 105.6 12.44 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -84.63 153.61 23.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -67.18 -33.96 76.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 118.712 -0.661 . . . . 0.0 110.571 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 63.31 135.62 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.93 3.292 . . . . 0.0 112.408 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 67.95 24.35 74.4 Favored Glycine 0 CA--C 1.534 1.221 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m -138.83 178.64 7.01 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.706 2.002 . . . . 0.0 112.286 -178.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.44 -169.02 0.6 Allowed 'General case' 0 C--O 1.24 0.599 0 C-N-CA 129.096 2.958 . . . . 0.0 107.694 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.258 35.2 p -79.32 119.39 22.31 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 117.534 -1.666 . . . . 0.0 108.324 -176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -169.2 147.74 3.83 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 130.212 3.405 . . . . 0.0 107.033 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -168.13 171.41 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 126.351 1.86 . . . . 0.0 107.979 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -126.68 127.74 70.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 42.7 t80 -141.08 147.24 38.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 177.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 4.9 t70 54.92 32.15 17.35 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.252 1.821 . . . . 0.0 109.691 -179.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 66.64 15.56 10.15 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 127.576 2.35 . . . . 0.0 113.357 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -123.66 154.77 38.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 124.395 1.078 . . . . 0.0 109.588 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.1 t -79.34 141.93 36.52 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -144.59 155.78 43.81 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.711 2.004 . . . . 0.0 111.493 -178.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -148.8 151.23 34.42 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 120.904 -1.122 . . . . 0.0 110.529 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 t -81.11 127.96 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 123.997 0.919 . . . . 0.0 110.626 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.3 p -98.14 164.4 12.34 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.803 1.241 . . . . 0.0 109.035 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.68 -12.37 61.3 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 126.506 1.922 . . . . 0.0 113.295 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.95 112.31 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.584 1.553 . . . . 0.0 109.208 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.402 ' C ' HD12 ' A' ' 33' ' ' ILE . 16.7 tt0 -96.83 146.92 24.46 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.719 0.808 . . . . 0.0 109.451 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.402 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.7 mp -114.04 135.22 22.08 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.604 1.962 . . . . 0.0 109.139 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.3 151.58 29.88 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.452 2.768 . . . . 0.0 111.564 178.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -58.5 -22.6 55.59 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.528 0.731 . . . . 0.0 112.749 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -67.45 -25.84 66.1 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.937 -0.477 . . . . 0.0 110.517 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -90.63 -20.01 23.02 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 111.399 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.1 t -65.13 126.15 23.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.49 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -83.47 -61.3 1.88 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.733 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.449 HD22 ' ND2' ' A' ' 39' ' ' ASN . 4.5 p30 -163.87 168.95 18.86 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 126.159 1.783 . . . . 0.0 109.16 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.441 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 15.9 m -63.16 155.35 28.36 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.155 0.982 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -120.42 -54.73 2.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.737 -0.602 . . . . 0.0 110.592 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.2 t -146.99 146.81 18.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.58 125.38 53.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 104.047 -2.575 . . . . 0.0 104.047 177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 158.43 44.06 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 126.274 1.83 . . . . 0.0 111.343 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.87 112.83 15.15 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.859 ' HE3' HD23 ' A' ' 49' ' ' LEU . 4.0 tmtm? -147.99 115.9 6.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.45 1.1 . . . . 0.0 109.113 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.4 tt -131.78 134.77 46.2 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.112 1.365 . . . . 0.0 107.823 178.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.859 HD23 ' HE3' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -148.53 170.97 16.88 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.853 1.661 . . . . 0.0 108.425 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mt -129.28 129.6 67.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.5 t -120.93 134.03 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.67 1.188 . . . . 0.0 108.966 -178.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' A' ' 59' ' ' LEU . 3.9 t70 -80.68 126.03 30.77 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.03 -1.043 . . . . 0.0 109.574 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 76.5 mtp -68.23 -17.79 64.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.608 1.549 . . . . 0.0 113.808 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -65.0 -52.03 58.37 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.164 0.893 . . . . 0.0 111.094 -179.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -122.19 6.25 9.71 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 60.66 24.79 14.56 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.484 1.514 . . . . 0.0 112.353 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.557 ' HE3' ' HA ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -93.27 151.15 19.98 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 120.931 -1.106 . . . . 0.0 109.157 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.485 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -70.8 146.21 49.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' A' ' 52' ' ' ASP . 50.6 mt -130.42 -179.59 5.35 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.328 2.251 . . . . 0.0 108.253 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.8 m -131.78 -5.06 3.62 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.693 1.197 . . . . 0.0 112.281 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -123.71 174.63 7.36 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 126.041 1.736 . . . . 0.0 106.963 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 t -109.28 110.44 21.63 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.262 87.5 m-20 -102.65 159.38 15.51 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 125.355 1.462 . . . . 0.0 107.747 178.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -70.52 -12.87 61.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.211 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -100.62 5.52 43.9 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 120.439 1.472 . . . . 0.0 110.55 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.7 t -113.78 173.75 6.27 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.012 1.725 . . . . 0.0 112.053 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 52.5 t -142.59 130.41 19.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 C-N-CA 125.731 1.612 . . . . 0.0 107.784 178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 t -75.04 135.09 41.27 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.409 ' HA ' HD21 ' A' ' 87' ' ' ASN . 86.1 mt -125.84 132.33 52.24 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 120.8 -1.187 . . . . 0.0 108.332 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -113.31 107.84 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.53 92.04 3.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.909 1.232 . . . . 0.0 110.981 -178.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.14 -164.34 0.53 Allowed 'General case' 0 CA--C 1.508 -0.672 0 O-C-N 121.199 -0.938 . . . . 0.0 111.736 -178.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.94 66.79 0.87 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 123.882 0.739 . . . . 0.0 111.636 176.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 6.7 mt -79.61 138.61 19.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.3 m-85 -134.69 168.83 18.3 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 126.13 1.772 . . . . 0.0 107.768 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -110.9 157.9 19.34 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.486 1.514 . . . . 0.0 108.141 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.77 162.59 17.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 125.348 1.459 . . . . 0.0 109.457 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.1 t -56.42 -29.98 62.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.486 0.714 . . . . 0.0 111.098 179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -85.08 12.29 8.04 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.82 -1.175 . . . . 0.0 112.517 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm 75.3 1.99 3.79 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.546 1.939 . . . . 0.0 110.462 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 m -74.72 167.69 21.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.439 1.096 . . . . 0.0 110.108 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.78 148.58 45.19 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.492 1.117 . . . . 0.0 110.204 -178.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.4 p -140.2 171.07 14.69 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.08 0.952 . . . . 0.0 109.414 178.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.5 ttm -131.36 134.65 46.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.357 1.863 . . . . 0.0 110.718 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.24 103.78 2.53 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 126.743 2.116 . . . . 0.0 110.573 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 65.7 mt -117.43 113.97 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 125.899 1.68 . . . . 0.0 108.074 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.409 HD21 ' HA ' ' A' ' 69' ' ' LEU . 71.4 m-80 47.84 54.01 10.57 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 124.743 1.217 . . . . 0.0 112.585 178.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 75.21 -4.64 2.33 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.518 1.927 . . . . 0.0 115.473 178.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -115.85 147.48 40.99 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.378 1.445 . . . . 0.0 109.626 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -99.85 116.92 33.04 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -108.09 133.44 52.37 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 124.964 1.305 . . . . 0.0 111.176 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -67.87 151.09 47.72 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.19 -0.944 . . . . 0.0 110.059 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -118.58 133.66 64.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -119.59 156.75 53.25 Favored Pre-proline 0 N--CA 1.467 0.39 0 C-N-CA 125.238 1.415 . . . . 0.0 108.848 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.51 156.1 64.93 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.483 2.122 . . . . 0.0 109.888 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.36 65.18 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.577 -0.702 . . . . 0.0 109.68 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.0 t -70.88 -0.7 9.71 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.107 0.963 . . . . 0.0 110.516 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -99.97 -3.77 31.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.033 -1.667 . . . . 0.0 112.959 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -53.05 164.41 0.41 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.606 1.193 . . . . 0.0 112.701 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.62 -41.77 3.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 125.118 1.342 . . . . 0.0 111.823 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.75 -28.24 19.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.417 1.087 . . . . 0.0 110.573 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.9 p -134.02 162.9 38.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 127.38 2.272 . . . . 0.0 106.402 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -134.39 172.56 12.72 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.818 2.447 . . . . 0.0 106.875 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.68 168.71 14.3 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.23 172.51 6.85 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.711 -0.618 . . . . 0.0 112.46 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -118.22 138.88 52.03 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.341 1.056 . . . . 0.0 110.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.403 HD12 ' H ' ' A' ' 107' ' ' LEU . 1.6 mp -70.85 -13.13 61.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.162 0.585 . . . . 0.0 110.04 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -61.48 -10.13 7.11 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 127.243 2.217 . . . . 0.0 113.18 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -96.1 -4.65 42.45 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.726 0.81 . . . . 0.0 112.706 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 C--O 1.25 1.099 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.226 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 17.4 t80 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 117.643 -1.17 . . . . 0.0 113.064 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -106.55 33.95 3.64 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 120.682 1.583 . . . . 0.0 112.335 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.7 m -69.95 128.23 35.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.609 -1.307 . . . . 0.0 113.032 -178.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 t -161.48 160.46 29.24 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.521 1.529 . . . . 0.0 108.405 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -152.8 110.87 3.65 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.098 1.359 . . . . 0.0 109.065 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -137.91 160.45 39.29 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 125.268 1.427 . . . . 0.0 107.468 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm -64.24 162.21 15.08 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.2 t -99.13 137.15 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -102.46 103.05 13.4 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 103.688 -2.708 . . . . 0.0 103.688 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -80.59 166.63 20.94 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 124.493 1.117 . . . . 0.0 110.697 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 15' ' ' SER . 2.2 p30 -59.24 -33.58 71.18 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.709 1.604 . . . . 0.0 113.798 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 51.19 91.96 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.101 2.56 . . . . 0.0 113.477 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 65.07 38.7 95.67 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 113.748 -1.569 . . . . 0.0 111.904 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 5.0 m -139.38 -179.89 6.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.349 2.259 . . . . 0.0 109.647 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.66 -170.07 0.8 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.617 1.567 . . . . 0.0 108.358 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 33.8 p -79.49 121.76 25.6 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 123.994 1.854 . . . . 0.0 110.438 -175.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -167.14 149.42 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 129.584 3.154 . . . . 0.0 107.234 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.47 ' CZ ' HD12 ' A' ' 93' ' ' ILE . 38.8 p90 -164.27 167.27 20.11 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 25.7 mt -131.53 112.83 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 O-C-N 120.452 -1.405 . . . . 0.0 108.278 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.416 ' CE2' ' HB2' ' A' ' 22' ' ' ASP . 86.9 t80 -117.55 137.07 52.83 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.067 0.947 . . . . 0.0 108.608 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.416 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 3.3 t70 55.25 34.22 22.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.175 1.79 . . . . 0.0 114.042 179.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 69.78 17.65 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.844 2.458 . . . . 0.0 111.933 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -119.08 138.24 53.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.963 1.705 . . . . 0.0 106.944 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.2 m -82.42 136.95 34.83 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -137.67 166.41 24.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.561 1.944 . . . . 0.0 112.125 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -148.99 163.66 36.86 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 123.495 0.718 . . . . 0.0 110.725 177.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 t -96.01 122.52 47.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 124.785 1.234 . . . . 0.0 108.466 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.78 172.82 7.01 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.517 1.127 . . . . 0.0 110.009 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -74.9 -14.98 60.71 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.303 1.841 . . . . 0.0 113.503 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HE2' HG23 ' A' ' 102' ' ' VAL . 0.0 OUTLIER -69.51 110.95 5.03 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.065 0.946 . . . . 0.0 110.315 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.19 146.81 24.38 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.36 1.064 . . . . 0.0 108.524 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.401 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.6 mp -117.71 137.17 24.02 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 126.528 1.931 . . . . 0.0 105.946 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.6 153.05 49.02 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.447 2.098 . . . . 0.0 111.47 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -57.21 -30.19 64.36 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -65.9 -15.6 63.09 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.783 0.719 . . . . 0.0 112.686 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -97.9 -14.44 20.67 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.988 0.915 . . . . 0.0 111.14 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.405 HG21 ' CD2' ' A' ' 90' ' ' TYR . 69.9 t -78.23 135.35 26.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.125 0 C-N-CA 124.602 1.161 . . . . 0.0 108.001 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.66 -61.34 1.66 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.359 1.464 . . . . 0.0 111.038 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -156.23 158.71 38.01 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.7 t -70.45 131.43 44.04 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 178.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttp -101.12 -51.93 3.4 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 117.153 -1.403 . . . . 0.0 114.535 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.9 t -141.39 133.48 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 119.027 0.831 . . . . 0.0 110.191 -178.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.21 117.2 33.43 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.335 1.054 . . . . 0.0 109.445 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -148.77 157.44 43.44 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.628 1.971 . . . . 0.0 110.128 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -123.3 120.71 33.88 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 120.963 -1.085 . . . . 0.0 108.398 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.4 tptm -147.51 124.02 11.05 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.725 1.21 . . . . 0.0 107.818 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 tt -134.19 143.96 48.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.623 1.969 . . . . 0.0 109.407 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -153.72 169.57 23.0 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 125.369 1.468 . . . . 0.0 107.838 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mt -130.33 133.82 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 125.192 1.397 . . . . 0.0 107.443 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.19 152.49 33.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 125.738 1.615 . . . . 0.0 108.129 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -88.89 124.83 34.58 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.347 1.859 . . . . 0.0 107.327 178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 72.9 mtp -68.35 -25.95 65.35 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 121.009 1.731 . . . . 0.0 109.863 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -53.56 54.09 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.362 1.065 . . . . 0.0 112.677 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -111.34 -6.14 14.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 65.0 20.2 12.05 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.819 1.19 . . . . 0.0 111.308 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -102.27 153.89 19.55 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.79 1.636 . . . . 0.0 108.637 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.77 154.59 39.51 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 118.335 0.516 . . . . 0.0 111.393 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.2 mt -135.56 160.28 38.98 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 125.791 1.636 . . . . 0.0 108.809 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -7.98 45.41 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.4 m -142.18 165.57 27.08 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.737 1.608 . . . . 0.0 110.071 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.4 p -92.39 117.01 29.48 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -132.23 163.06 29.42 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -47.38 -34.59 7.2 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -178.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -80.08 -7.1 58.71 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.829 -1.169 . . . . 0.0 112.634 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.8 t -120.55 164.28 16.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 127.346 2.258 . . . . 0.0 114.035 -176.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -137.32 161.38 34.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 127.012 2.125 . . . . 0.0 106.353 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.1 t -110.87 144.84 39.29 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.016 1.327 . . . . 0.0 109.487 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.1 mt -131.19 144.72 51.56 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 5.0 t -122.94 101.73 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 101.658 -3.46 . . . . 0.0 101.658 177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -87.87 96.07 10.34 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -178.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.01 -161.62 0.33 Allowed 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.59 66.93 1.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.639 1.576 . . . . 0.0 111.455 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 mt -79.36 137.1 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.166 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -134.99 168.86 18.34 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.967 1.707 . . . . 0.0 109.212 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -116.96 147.1 42.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.31 168.47 10.0 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 126.251 1.82 . . . . 0.0 110.637 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.9 t -60.31 -35.15 74.93 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -83.15 18.2 1.78 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.986 1.314 . . . . 0.0 112.178 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmmt 65.26 12.5 8.09 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.256 1.422 . . . . 0.0 110.43 -179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.8 t -81.29 169.29 17.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.4 mt -123.55 154.99 38.45 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.413 0.685 . . . . 0.0 112.377 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 19.4 p -146.98 171.78 14.72 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.901 0.88 . . . . 0.0 110.035 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 45.2 ttm -133.58 135.98 44.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.368 1.867 . . . . 0.0 108.651 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.0 115.74 4.17 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 126.174 1.845 . . . . 0.0 112.865 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -132.76 122.84 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 55.7 36.92 28.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.39 1.876 . . . . 0.0 110.777 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.4 t0 70.02 13.82 7.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.14 2.176 . . . . 0.0 114.173 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -116.48 138.54 51.3 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.843 1.657 . . . . 0.0 107.823 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD2' HG21 ' A' ' 38' ' ' VAL . 18.6 m-85 -91.2 116.88 29.17 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.798 -0.564 . . . . 0.0 110.448 -179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -106.07 124.56 49.77 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.224 1.409 . . . . 0.0 107.597 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.401 ' HB2' HD13 ' A' ' 33' ' ' ILE . 11.1 ttpp -60.53 157.51 14.1 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.157 -0.964 . . . . 0.0 111.307 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.47 HD12 ' CZ ' ' A' ' 19' ' ' PHE . 1.1 pt -121.99 134.54 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -127.01 158.74 67.87 Favored Pre-proline 0 N--CA 1.469 0.484 0 C-N-CA 125.093 1.357 . . . . 0.0 107.877 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.08 153.69 67.21 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.161 1.907 . . . . 0.0 109.171 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 99' ' ' LYS . 17.2 pt-20 -65.53 -19.79 66.07 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 119.892 -0.723 . . . . 0.0 110.747 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.8 t -63.82 -19.46 65.04 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.266 1.426 . . . . 0.0 110.894 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -84.88 2.17 43.84 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 96' ' ' GLU . 36.3 mtmt -55.5 154.6 6.25 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.883 0.765 . . . . 0.0 110.033 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.76 -21.72 35.7 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.078 0.847 . . . . 0.0 111.83 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.15 -12.43 6.91 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 118.86 1.33 . . . . 0.0 111.182 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.416 HG23 ' HE2' ' A' ' 31' ' ' LYS . 3.8 p -141.35 155.86 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 C-N-CA 125.655 1.582 . . . . 0.0 107.286 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -130.06 164.73 23.71 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.999 1.72 . . . . 0.0 108.211 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 164.6 12.99 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.48 160.0 11.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.386 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 mmt85 -107.35 133.18 52.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 124.217 1.007 . . . . 0.0 111.275 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.47 -23.06 67.15 Favored 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.759 1.224 . . . . 0.0 110.041 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.11 -9.2 2.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.042 1.337 . . . . 0.0 113.664 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -84.43 -8.04 59.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.18 0.992 . . . . 0.0 111.053 178.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 C--O 1.245 0.86 0 C-N-CA 124.367 1.067 . . . . 0.0 111.17 -176.602 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.0 p90 . . . . . 0 N--CA 1.468 0.434 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -67.01 139.74 57.68 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 105.871 -1.899 . . . . 0.0 105.871 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 t -133.89 3.27 3.47 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -76.83 47.03 0.49 Allowed 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.665 1.121 . . . . 0.0 111.094 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -79.81 61.29 3.7 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.821 1.648 . . . . 0.0 107.291 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -106.69 167.32 9.95 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 125.8 1.64 . . . . 0.0 106.699 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.94 154.55 30.02 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.519 -0.738 . . . . 0.0 110.494 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.6 t -102.47 115.75 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 102.476 -3.157 . . . . 0.0 102.476 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -80.49 113.75 18.89 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.24 150.5 25.41 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -71.56 -34.05 69.63 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 119.636 -0.826 . . . . 0.0 111.358 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 66.51 137.44 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 128.174 2.59 . . . . 0.0 112.508 179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.9 26.04 39.61 Favored Glycine 0 CA--C 1.533 1.172 0 O-C-N 121.294 -0.879 . . . . 0.0 113.202 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.5 m -140.26 177.68 7.82 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.519 1.928 . . . . 0.0 111.291 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.06 -168.33 0.61 Allowed 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.564 2.345 . . . . 0.0 107.025 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -79.85 121.87 25.95 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 119.781 -1.824 . . . . 0.0 110.113 -176.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -167.26 146.68 5.2 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 130.792 3.637 . . . . 0.0 105.646 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -168.79 167.4 11.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.259 1.424 . . . . 0.0 108.226 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 22.5 mt -130.92 113.22 23.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 O-C-N 121.595 -0.691 . . . . 0.0 109.251 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -120.01 139.98 51.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 53.27 33.2 14.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 123.029 1.395 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 56.84 30.14 17.32 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 128.034 2.534 . . . . 0.0 111.632 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.9 mtpp -123.16 132.37 54.04 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.682 1.993 . . . . 0.0 105.634 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.5 p -71.45 139.67 49.73 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -145.66 163.08 35.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.156 1.782 . . . . 0.0 109.385 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 p90 -149.14 162.02 40.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.9 t -95.75 127.04 48.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.407 HG21 HD23 ' A' ' 94' ' ' LEU . 26.3 p -96.57 171.86 8.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.693 1.597 . . . . 0.0 110.574 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.42 -10.25 59.35 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.542 1.937 . . . . 0.0 112.41 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.09 103.55 1.56 Allowed 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 126.081 1.752 . . . . 0.0 110.173 -179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.418 ' C ' HD12 ' A' ' 33' ' ' ILE . 31.3 tt0 -94.29 142.25 27.63 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.418 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.9 mp -116.21 142.63 29.62 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 124.331 1.052 . . . . 0.0 109.389 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 33' ' ' ILE . 96.0 Cg_endo -77.9 150.62 27.05 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.649 2.899 . . . . 0.0 110.408 178.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -54.37 -29.99 50.39 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -63.36 -19.96 65.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.264 179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -97.69 -14.05 21.12 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 118.417 0.553 . . . . 0.0 111.749 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -76.62 119.84 25.65 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.458 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -77.24 -61.49 1.97 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.13 -0.462 . . . . 0.0 111.394 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.56 173.74 15.06 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.074 0.95 . . . . 0.0 110.809 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.496 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -63.21 163.47 10.24 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.7 1.2 . . . . 0.0 111.452 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -134.1 -53.19 0.85 Allowed 'General case' 0 CA--C 1.518 -0.261 0 O-C-N 121.075 -1.016 . . . . 0.0 109.241 179.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -144.68 132.33 16.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -108.46 92.65 4.14 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.541 1.162 . . . . 0.0 109.569 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -132.09 156.49 46.23 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 128.345 2.658 . . . . 0.0 105.738 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -134.94 118.3 16.73 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.494 1.918 . . . . 0.0 108.281 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.607 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -146.71 137.62 24.04 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -134.63 145.58 48.74 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.641 1.977 . . . . 0.0 107.839 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -151.54 170.29 20.01 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 107.302 179.325 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.443 ' O ' HD13 ' A' ' 58' ' ' LEU . 39.5 mt -127.5 128.79 70.17 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.154 0 C-N-CA 123.316 0.646 . . . . 0.0 109.329 -177.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.78 137.09 51.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 125.464 1.506 . . . . 0.0 110.554 -178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.88 117.04 23.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 129.284 3.034 . . . . 0.0 111.784 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 70.3 mtp -68.2 -14.49 63.02 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.683 -1.261 . . . . 0.0 112.247 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -69.74 -53.32 18.96 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.827 -1.17 . . . . 0.0 111.53 178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.8 m -122.79 10.53 9.6 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 58.95 21.08 8.82 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.178 1.391 . . . . 0.0 112.873 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 mtmm -96.81 161.73 13.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 123.742 0.817 . . . . 0.0 110.59 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.5 mm? -82.95 153.61 24.95 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.1 mt -135.18 160.93 36.8 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.696 1.198 . . . . 0.0 110.437 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.9 m -78.84 -25.8 44.11 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.04 0.536 . . . . 0.0 110.4 177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.27 158.66 43.78 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 124.505 1.122 . . . . 0.0 108.906 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.09 116.5 27.41 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.78 173.84 9.18 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -63.23 -18.59 63.7 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.137 -0.977 . . . . 0.0 112.238 177.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -103.6 18.18 22.45 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.458 1.503 . . . . 0.0 109.758 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -125.34 158.57 33.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.246 1.818 . . . . 0.0 108.609 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.0 t -133.31 145.58 33.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 125.068 1.347 . . . . 0.0 107.572 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -93.7 137.23 33.17 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -129.66 136.25 49.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.6 t -107.58 103.35 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 102.998 -2.964 . . . . 0.0 102.998 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.402 ' CD2' HD11 ' A' ' 49' ' ' LEU . 2.8 mm? -95.9 92.19 6.39 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 -166.06 0.89 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 51.67 67.49 0.95 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 122.557 1.17 . . . . 0.0 112.314 176.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.5 mt -79.83 134.35 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.984 -1.073 . . . . 0.0 109.957 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.496 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 40.9 m-85 -135.16 169.86 16.8 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.735 2.014 . . . . 0.0 110.452 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -112.93 159.79 18.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.144 2.178 . . . . 0.0 109.866 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.76 169.56 9.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.218 1.407 . . . . 0.0 110.593 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -25.36 63.49 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.44 0.696 . . . . 0.0 112.011 179.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -98.8 15.15 26.32 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.09 -1.006 . . . . 0.0 112.338 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp 71.69 2.32 4.24 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.969 1.708 . . . . 0.0 112.617 -179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 67.7 m -70.28 159.36 34.2 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -114.04 156.66 23.71 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 121.26 -0.9 . . . . 0.0 111.046 -178.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.2 p -143.77 170.96 14.89 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.158 0.983 . . . . 0.0 110.088 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.5 ttm -134.59 137.37 43.68 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 126.618 1.967 . . . . 0.0 108.982 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.86 124.11 6.38 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 126.194 1.854 . . . . 0.0 109.98 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.5 mt -144.18 120.87 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 53.1 45.5 28.58 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.545 0.738 . . . . 0.0 110.843 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.6 t0 60.33 17.65 7.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.52 1.928 . . . . 0.0 113.995 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.1 137.48 54.91 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 126.27 1.828 . . . . 0.0 108.269 -179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.58 116.99 29.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 122.488 0.315 . . . . 0.0 110.773 -178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -106.19 125.78 51.42 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.288 1.435 . . . . 0.0 109.451 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.5 ttpp -62.66 145.35 54.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.713 0.805 . . . . 0.0 110.75 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.76 133.01 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 N-CA-C 106.079 -1.823 . . . . 0.0 106.079 179.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.407 HD23 HG21 ' A' ' 29' ' ' THR . 4.4 mm? -124.99 156.57 69.03 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.557 1.143 . . . . 0.0 109.777 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.08 141.64 33.09 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 N-CA-C 107.301 -1.846 . . . . 0.0 107.301 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -58.96 -13.75 7.31 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.7 t -68.8 -16.35 63.77 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.65 -6.2 54.87 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 119.638 1.108 . . . . 0.0 113.473 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -56.03 157.69 4.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.886 0.851 . . . . 0.0 109.719 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.93 -23.5 35.75 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 108.353 -1.899 . . . . 0.0 108.353 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -113.95 -7.35 13.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.004 2.121 . . . . 0.0 109.393 177.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 p -156.98 158.01 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 129.083 2.953 . . . . 0.0 105.242 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -135.6 170.66 15.62 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.979 1.712 . . . . 0.0 106.732 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.1 162.74 11.14 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.541 0.686 . . . . 0.0 110.979 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.643 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.17 163.2 3.87 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.498 -179.223 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.643 ' N ' HD12 ' A' ' 105' ' ' LEU . 40.9 mtm180 -116.48 139.14 50.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 124.289 1.036 . . . . 0.0 111.684 -177.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.51 -19.62 62.17 Favored 'General case' 0 C--O 1.22 -0.464 0 O-C-N 123.963 0.789 . . . . 0.0 110.797 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.2 -2.88 2.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.417 1.887 . . . . 0.0 113.158 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -93.71 0.57 56.47 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.039 -1.038 . . . . 0.0 110.003 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 . . . . . 0 C--O 1.248 0.981 0 C-N-CA 125.049 1.339 . . . . 0.0 110.906 -178.046 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 42.7 p90 . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 118.038 -0.982 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.84 141.19 57.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.859 1.663 . . . . 0.0 108.146 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.2 p -141.87 108.79 5.43 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 118.624 0.647 . . . . 0.0 110.678 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 t -164.35 164.35 22.23 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -52.97 -38.25 61.96 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.248 1.019 . . . . 0.0 111.989 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt 44.29 54.89 5.9 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.782 1.633 . . . . 0.0 110.308 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -46.21 118.73 2.02 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.356 1.062 . . . . 0.0 109.221 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -81.23 138.17 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 124.523 1.129 . . . . 0.0 108.213 -178.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -106.6 133.32 51.46 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -102.55 161.12 13.97 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -66.31 -32.89 74.56 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 64.93 137.85 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 128.627 2.771 . . . . 0.0 112.851 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 54.34 28.83 44.64 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.6 t -139.97 178.35 7.32 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.106 2.162 . . . . 0.0 110.923 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.59 -169.49 0.7 Allowed 'General case' 0 C--O 1.246 0.89 1 C-N-CA 132.02 4.128 . . . . 0.0 107.867 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.9 p -80.61 118.84 22.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 116.956 -1.897 . . . . 0.0 108.682 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -169.13 144.95 3.31 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 130.677 3.591 . . . . 0.0 105.676 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 37.4 p90 -165.49 177.86 7.15 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.555 1.142 . . . . 0.0 108.926 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 42.9 mt -133.86 125.76 49.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -139.06 140.74 38.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.371 1.468 . . . . 0.0 108.564 178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t0 48.52 40.88 16.11 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.243 2.217 . . . . 0.0 113.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.9 m120 67.77 22.96 8.7 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 127.797 2.439 . . . . 0.0 114.042 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 mtpp -130.55 152.8 49.53 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.166 0.986 . . . . 0.0 109.185 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.2 t -79.19 143.39 35.44 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.3 m-85 -147.19 161.08 41.64 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 122.727 0.411 . . . . 0.0 111.248 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.462 ' CE2' HG22 ' A' ' 29' ' ' THR . 47.0 p90 -148.7 159.6 43.96 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.583 0.753 . . . . 0.0 109.453 178.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.0 t -92.49 127.79 44.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.462 HG22 ' CE2' ' A' ' 27' ' ' PHE . 1.1 p -99.47 171.98 7.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.004 0.906 . . . . 0.0 110.91 -178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -76.36 -5.69 48.29 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 127.11 2.164 . . . . 0.0 113.1 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -81.46 104.14 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 124.327 1.051 . . . . 0.0 109.614 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -92.03 140.85 29.24 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.5 mp -117.13 135.47 23.1 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.83 152.6 68.97 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.097 2.531 . . . . 0.0 111.205 -178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.37 -26.08 66.35 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 122.008 -0.432 . . . . 0.0 110.992 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -66.58 -19.5 65.79 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.59 -0.694 . . . . 0.0 112.044 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -96.55 -14.77 22.02 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.066 1.746 . . . . 0.0 111.028 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.3 t -67.5 139.11 21.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.404 HD22 ' ND2' ' A' ' 40' ' ' ASN . 12.2 t30 -88.06 -54.18 4.35 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.151 1.38 . . . . 0.0 110.807 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.404 ' ND2' HD22 ' A' ' 39' ' ' ASN . 0.0 OUTLIER -171.06 169.33 6.61 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.314 1.446 . . . . 0.0 110.892 -179.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.6 p -65.55 161.09 20.96 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.274 1.83 . . . . 0.0 109.466 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -130.62 -56.05 1.07 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.573 -1.203 . . . . 0.0 112.306 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.9 t -148.79 143.73 18.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 119.194 0.906 . . . . 0.0 111.444 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -121.96 109.28 14.41 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.967 1.307 . . . . 0.0 109.82 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -136.81 156.69 48.17 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 130.853 3.661 . . . . 0.0 105.723 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -117.7 114.94 24.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.576 1.08 . . . . 0.0 109.941 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.576 ' HE3' HD23 ' A' ' 49' ' ' LEU . 9.3 tptm -147.02 122.58 10.44 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.073 0.949 . . . . 0.0 109.556 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.416 HD12 HG22 ' A' ' 70' ' ' VAL . 9.7 tt -135.76 141.34 44.81 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.943 2.097 . . . . 0.0 107.578 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.61 HD22 HD11 ' A' ' 58' ' ' LEU . 0.8 OUTLIER -151.61 171.31 17.82 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 124.682 1.193 . . . . 0.0 109.725 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.471 ' O ' HD13 ' A' ' 58' ' ' LEU . 60.2 mt -123.98 130.52 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.7 t -125.88 151.92 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 125.511 1.525 . . . . 0.0 107.238 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -101.52 126.58 48.35 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.2 1.364 . . . . 0.0 108.321 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.8 mtp -64.91 -21.19 66.77 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.793 1.633 . . . . 0.0 112.323 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -54.56 38.96 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 119.052 0.842 . . . . 0.0 112.795 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.2 m -112.62 -2.51 14.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.755 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 59.5 34.61 22.57 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.468 1.907 . . . . 0.0 111.162 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -111.82 156.75 21.48 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.494 0.717 . . . . 0.0 110.464 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.61 HD11 HD22 ' A' ' 49' ' ' LEU . 3.6 mm? -67.53 142.45 56.54 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.416 1.087 . . . . 0.0 110.12 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.3 mt -120.7 175.72 5.88 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.142 1.777 . . . . 0.0 110.787 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.2 m -116.2 3.67 13.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.586 2.355 . . . . 0.0 111.019 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.1 t -160.16 160.79 33.3 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 p -97.68 121.18 39.28 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 125.346 1.459 . . . . 0.0 107.679 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -127.65 168.29 15.23 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.382 1.073 . . . . 0.0 110.607 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -50.74 -41.84 56.93 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -77.74 -1.68 32.47 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.769 0.713 . . . . 0.0 111.535 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.6 t -112.77 163.5 14.51 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 125.804 1.642 . . . . 0.0 110.831 -178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.32 134.26 17.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 C-N-CA 129.315 3.046 . . . . 0.0 104.935 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.49 144.23 28.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -127.24 145.44 50.78 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.416 HG22 HD12 ' A' ' 48' ' ' LEU . 7.7 t -120.43 104.14 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 103.141 -2.911 . . . . 0.0 103.141 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -98.23 93.76 6.41 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -169.17 -167.48 0.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 49.89 67.98 0.82 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.836 1.654 . . . . 0.0 113.123 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.6 mt -71.47 144.42 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.353 1.461 . . . . 0.0 111.952 -178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -137.36 169.46 17.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.373 2.669 . . . . 0.0 110.102 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -121.48 154.65 36.32 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 126.414 1.886 . . . . 0.0 108.136 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.88 166.97 10.51 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 125.753 1.621 . . . . 0.0 109.978 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m -62.17 -27.56 69.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.415 0.286 . . . . 0.0 111.054 178.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -84.35 15.42 3.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.834 1.254 . . . . 0.0 110.471 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.9 mmmm 66.57 4.44 3.34 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.9 1.68 . . . . 0.0 111.056 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.01 164.65 26.38 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 178.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 45.0 mt -116.66 155.22 29.19 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.585 0.754 . . . . 0.0 109.145 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 24.3 p -147.81 166.75 26.63 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.89 0.476 . . . . 0.0 110.039 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 50.5 ttm -130.86 141.95 50.35 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 126.077 1.751 . . . . 0.0 110.249 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.27 121.82 5.66 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 125.49 1.519 . . . . 0.0 110.483 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 55.2 mt -140.77 116.72 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 104.451 -2.426 . . . . 0.0 104.451 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 53.44 51.13 15.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.81 0.844 . . . . 0.0 110.628 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 62.4 -2.89 0.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.389 2.676 . . . . 0.0 115.769 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -101.98 138.35 39.05 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 126.368 1.867 . . . . 0.0 108.581 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -96.21 116.48 29.07 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -105.8 127.86 53.36 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.873 1.669 . . . . 0.0 109.33 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.415 ' HB2' HD13 ' A' ' 33' ' ' ILE . 23.3 ttpt -63.41 150.73 42.89 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.994 0.918 . . . . 0.0 110.152 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -119.3 133.68 65.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 179.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -126.07 161.24 52.82 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.388 1.075 . . . . 0.0 110.03 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -70.45 153.83 65.46 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.864 2.376 . . . . 0.0 109.611 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.2 pm0 -56.56 -22.83 36.1 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.491 0.716 . . . . 0.0 110.819 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.6 m -57.17 -22.65 41.93 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.903 1.681 . . . . 0.0 111.19 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -76.31 1.1 17.09 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.731 1.212 . . . . 0.0 113.2 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.75 143.21 37.54 Favored 'General case' 0 C--O 1.234 0.278 0 O-C-N 120.968 -1.083 . . . . 0.0 110.61 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 104.82 -42.44 1.9 Allowed Glycine 0 CA--C 1.522 0.508 0 C-N-CA 125.806 1.669 . . . . 0.0 110.737 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -111.65 -16.1 13.31 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.587 1.193 . . . . 0.0 111.771 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.51 143.47 41.06 Favored 'Isoleucine or valine' 0 C--O 1.242 0.695 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -135.15 169.61 17.18 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 124.465 1.106 . . . . 0.0 108.929 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.9 158.37 30.83 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.509 0.671 . . . . 0.0 109.602 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.19 164.12 13.83 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.489 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -113.24 135.78 53.45 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.362 1.065 . . . . 0.0 110.032 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.539 HD12 ' H ' ' A' ' 107' ' ' LEU . 0.7 OUTLIER -65.43 -10.64 35.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.971 1.709 . . . . 0.0 111.386 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -60.29 -25.36 65.68 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.696 1.599 . . . . 0.0 111.47 179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -72.79 -0.23 12.77 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.424 -1.75 . . . . 0.0 109.397 -177.914 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.2 t80 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -141.0 -76.84 0.3 Allowed 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.429 ' HB ' ' HE3' ' A' ' 7' ' ' LYS . 20.4 p -73.19 123.04 22.87 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 120.085 1.311 . . . . 0.0 110.8 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 m -125.81 -19.47 4.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.585 1.554 . . . . 0.0 112.674 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -129.37 100.71 5.68 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.931 1.293 . . . . 0.0 108.919 -179.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.429 ' HE3' ' HB ' ' A' ' 4' ' ' THR . 10.3 mtmp? -134.81 166.23 23.46 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.308 0.643 . . . . 0.0 111.536 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -59.61 155.35 15.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.293 1.437 . . . . 0.0 109.97 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.61 153.49 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -120.69 122.02 39.54 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 102.865 -3.013 . . . . 0.0 102.865 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 33.2 m-85 -105.71 -178.03 3.53 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 120.822 1.646 . . . . 0.0 112.633 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -56.95 -33.95 67.53 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 129.153 2.981 . . . . 0.0 115.15 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 38.34 70.71 0.19 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 127.911 2.484 . . . . 0.0 114.28 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.0 7.97 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 113.6 -1.636 . . . . 0.0 111.981 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 179.26 6.57 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.021 0.928 . . . . 0.0 110.533 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -73.1 -169.62 0.64 Allowed 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.9 p -78.29 122.07 25.25 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 119.467 -2.021 . . . . 0.0 110.559 -174.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -166.27 147.03 6.4 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 130.479 3.512 . . . . 0.0 105.938 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 36.5 p90 -167.0 172.76 9.88 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 125.439 1.495 . . . . 0.0 107.917 178.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.2 mt -134.95 121.94 35.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 O-C-N 120.537 -1.352 . . . . 0.0 108.669 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -132.62 137.36 46.99 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.136 1.374 . . . . 0.0 107.83 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.45 34.13 17.55 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 125.149 1.38 . . . . 0.0 112.915 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 71.52 9.79 6.44 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.131 2.572 . . . . 0.0 113.277 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -111.04 139.17 46.63 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -77.23 134.04 38.71 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 3.5 m-85 -137.28 166.63 23.33 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 125.037 1.335 . . . . 0.0 110.354 -178.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -149.21 170.47 18.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.3 t -105.04 123.42 59.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 p -92.81 169.51 10.41 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.91 1.684 . . . . 0.0 110.503 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -79.2 -10.16 59.75 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.258 1.423 . . . . 0.0 111.978 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.74 100.15 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.826 0.851 . . . . 0.0 109.039 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -86.49 147.21 26.08 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -117.76 137.43 24.31 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.99 1.316 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.83 147.47 75.04 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.729 2.286 . . . . 0.0 109.326 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -55.78 -32.96 63.93 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.387 0.675 . . . . 0.0 112.728 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -64.9 -21.88 66.89 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.954 0.901 . . . . 0.0 112.075 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -90.98 -19.76 22.87 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.489 -0.757 . . . . 0.0 110.432 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.9 t -70.3 129.55 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.513 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -83.12 -61.58 1.82 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.74 0.816 . . . . 0.0 110.529 -179.322 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -161.12 169.67 21.9 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.483 0.583 . . . . 0.0 110.763 -178.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.7 p -64.77 153.03 41.11 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.026 0.93 . . . . 0.0 109.327 179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.589 ' HE3' HD12 ' A' ' 82' ' ' LEU . 8.6 ttmm -124.66 -50.36 1.74 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.2 t -149.71 140.69 16.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -106.84 121.08 43.68 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.802 1.241 . . . . 0.0 108.073 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -150.3 159.03 44.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.423 3.489 . . . . 0.0 105.85 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -140.45 107.39 5.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -138.36 129.8 27.6 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.5 tt -137.84 138.41 39.1 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.17 169.3 18.14 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 125.284 1.433 . . . . 0.0 107.343 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 65.7 mt -124.43 131.21 73.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.3 t -122.25 127.62 75.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 124.865 1.266 . . . . 0.0 110.837 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HB2' HD21 ' A' ' 59' ' ' LEU . 38.2 t70 -74.63 100.16 3.86 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 126.794 2.038 . . . . 0.0 107.482 178.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 73.1 mtp -55.22 -29.14 57.38 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.488 0.585 . . . . 0.0 112.157 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.64 84.67 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 125.03 1.332 . . . . 0.0 113.556 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -121.85 -4.63 9.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.955 1.252 . . . . 0.0 112.216 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 63.26 34.57 13.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.769 2.028 . . . . 0.0 110.291 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -119.83 157.14 29.28 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.095 0.958 . . . . 0.0 110.937 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.44 151.41 44.02 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.022 0.529 . . . . 0.0 111.648 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 52' ' ' ASP . 46.4 mt -134.84 174.49 10.53 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.726 2.01 . . . . 0.0 109.07 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 21.0 p -117.16 -5.31 11.37 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.707 1.603 . . . . 0.0 112.705 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 m -144.88 129.97 18.5 Favored 'General case' 0 CA--C 1.521 -0.166 0 O-C-N 120.001 -1.687 . . . . 0.0 107.7 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.59 122.48 23.99 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -127.77 170.7 12.46 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.937 2.095 . . . . 0.0 108.349 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -58.63 -13.13 5.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 -177.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -104.9 8.64 34.71 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.827 1.194 . . . . 0.0 109.325 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.21 162.03 27.12 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.441 1.097 . . . . 0.0 112.793 -177.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -132.31 160.04 42.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 126.363 1.865 . . . . 0.0 108.251 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 t -105.72 142.7 34.99 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 76.0 mt -134.24 120.46 20.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.0 t -99.49 103.22 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -91.85 93.01 8.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 104.217 -2.512 . . . . 0.0 104.217 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.05 -169.22 2.12 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.12 67.4 0.84 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.848 2.059 . . . . 0.0 113.183 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.8 mt -73.59 146.81 9.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 O-C-N 121.057 -1.027 . . . . 0.0 111.064 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -142.75 169.47 17.51 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 126.674 1.989 . . . . 0.0 111.191 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -114.53 158.11 22.09 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 127.307 2.243 . . . . 0.0 106.103 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.58 167.41 14.54 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.597 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.5 t -62.99 -23.5 67.47 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 122.979 0.512 . . . . 0.0 111.481 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -86.7 6.63 30.33 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 120.805 -1.185 . . . . 0.0 109.47 179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm 68.89 1.18 3.02 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.976 2.51 . . . . 0.0 111.056 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.5 m -73.81 154.97 39.3 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.589 HD12 ' HE3' ' A' ' 42' ' ' LYS . 1.2 mm? -108.71 152.88 24.23 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.161 0.984 . . . . 0.0 110.341 -178.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 28.6 p -141.2 177.38 8.12 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.088 0.47 . . . . 0.0 111.864 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 55.9 ttm -136.69 138.23 40.83 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 126.234 1.814 . . . . 0.0 109.398 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.65 118.44 4.67 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 107.522 -2.231 . . . . 0.0 107.522 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 67.7 mt -135.03 123.35 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 49.95 45.13 25.38 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 123.789 0.681 . . . . 0.0 109.878 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 63.15 18.99 11.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.528 1.931 . . . . 0.0 114.836 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -124.46 144.78 49.89 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.173 0.989 . . . . 0.0 109.844 178.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -94.15 115.99 28.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.735 0.698 . . . . 0.0 112.047 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.81 124.07 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.205 1.402 . . . . 0.0 109.764 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -62.28 147.94 46.49 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.54 1.136 . . . . 0.0 111.425 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -115.95 134.33 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 123.887 0.875 . . . . 0.0 109.238 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -127.6 158.46 69.91 Favored Pre-proline 0 C--O 1.235 0.313 0 C-N-CA 124.671 1.189 . . . . 0.0 109.983 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -75.39 154.3 40.6 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.718 2.279 . . . . 0.0 110.811 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.94 -6.48 12.62 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.957 -0.465 . . . . 0.0 111.811 178.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.3 p -72.86 -14.55 61.52 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.488 -1.382 . . . . 0.0 110.451 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.21 -4.92 58.02 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 142.51 34.08 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.01 0.924 . . . . 0.0 111.208 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.53 -15.24 19.99 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 126.107 1.813 . . . . 0.0 111.079 -178.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.43 -12.68 0.8 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.473 1.509 . . . . 0.0 111.95 178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -126.1 150.24 31.49 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -141.57 162.74 34.74 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.103 1.361 . . . . 0.0 108.368 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.31 167.02 1.47 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.572 0.701 . . . . 0.0 112.884 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.16 161.25 13.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.693 0.759 . . . . 0.0 112.559 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.0 mmm-85 -109.24 117.26 33.65 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.3 -6.02 16.77 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.369 0.418 . . . . 0.0 111.795 179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -59.52 -23.49 62.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 110.491 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -69.14 -12.09 61.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.728 0.811 . . . . 0.0 112.554 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.943 1.697 . . . . 0.0 107.746 -178.526 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 11.8 t80 . . . . . 0 N--CA 1.464 0.227 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -53.66 154.19 3.89 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.092 0.957 . . . . 0.0 111.107 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.5 m -138.46 98.54 3.61 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 m -132.42 147.97 52.39 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.442 1.497 . . . . 0.0 109.655 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.413 ' O ' ' HE3' ' A' ' 7' ' ' LYS . 19.5 p80 -161.75 143.62 11.41 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.748 0.819 . . . . 0.0 110.23 179.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 6' ' ' HIS . 3.9 mmpt? -144.27 173.05 12.1 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 127.283 2.233 . . . . 0.0 107.599 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.48 154.46 20.7 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.148 0.885 . . . . 0.0 110.376 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.2 t -95.06 133.17 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 125.627 1.571 . . . . 0.0 107.997 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -95.52 122.16 37.97 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -89.38 161.56 16.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -68.98 -33.78 74.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.827 1.651 . . . . 0.0 111.602 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 46.68 99.18 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 127.291 2.236 . . . . 0.0 114.802 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.74 20.75 53.12 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.039 -1.437 . . . . 0.0 112.395 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -132.91 179.53 6.12 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.75 1.62 . . . . 0.0 111.661 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -169.94 0.98 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.056 2.142 . . . . 0.0 107.361 177.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.0 p -80.63 120.4 24.52 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 124.586 2.136 . . . . 0.0 111.681 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -168.58 153.54 6.24 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 130.941 3.696 . . . . 0.0 106.108 177.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -168.52 173.79 7.26 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.0 mt -132.92 120.19 40.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -130.58 138.13 50.0 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t0 55.57 35.22 24.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.601 1.56 . . . . 0.0 112.071 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 65.1 15.65 10.12 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 127.345 2.258 . . . . 0.0 112.842 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -118.66 142.1 47.98 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.9 m -75.63 142.83 42.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -139.8 162.57 34.82 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.076 1.751 . . . . 0.0 109.585 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -148.86 166.81 27.42 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 124.675 1.19 . . . . 0.0 109.129 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.1 t -97.33 128.64 48.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 C-N-CA 123.04 0.536 . . . . 0.0 109.599 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 HD23 ' A' ' 94' ' ' LEU . 27.0 p -97.0 170.25 9.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.129 0.972 . . . . 0.0 111.112 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -77.82 -14.43 59.58 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.962 1.305 . . . . 0.0 111.982 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -69.01 101.21 1.35 Allowed 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 125.264 1.426 . . . . 0.0 110.614 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.404 ' C ' HD12 ' A' ' 33' ' ' ILE . 27.0 tt0 -90.14 141.6 28.53 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.421 HG23 ' HD2' ' A' ' 34' ' ' PRO . 1.7 mp -118.14 143.98 33.95 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.482 1.113 . . . . 0.0 108.389 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 33' ' ' ILE . 74.5 Cg_endo -71.78 154.93 58.9 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 124.304 3.336 . . . . 0.0 113.383 -178.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -58.22 -33.34 69.21 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.124 0.97 . . . . 0.0 111.9 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -62.52 -23.16 66.8 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 123.748 0.819 . . . . 0.0 111.539 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -90.49 -22.84 21.15 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.184 0.594 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.0 t -62.98 119.3 6.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -77.5 -59.96 2.56 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.082 0.953 . . . . 0.0 110.223 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.72 169.37 20.11 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.511 0.725 . . . . 0.0 110.533 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.406 ' HA ' ' CD2' ' A' ' 75' ' ' TYR . 3.4 p -65.38 165.33 12.04 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.031 0.92 . . . . 0.0 108.724 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.89 -53.37 1.42 Allowed 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 120.785 -1.197 . . . . 0.0 108.631 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 t -140.86 145.4 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm -124.81 92.95 3.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.665 1.186 . . . . 0.0 108.566 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -137.32 155.31 49.59 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 128.962 2.905 . . . . 0.0 106.851 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -120.96 130.49 53.86 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.856 0.862 . . . . 0.0 111.844 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HE2' HD23 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -148.81 126.85 11.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.403 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.4 tt -131.25 145.06 51.75 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 128.179 2.592 . . . . 0.0 110.256 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.467 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -152.3 171.04 18.6 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.588 1.955 . . . . 0.0 109.506 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 25.4 mt -128.34 127.77 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.187 1.395 . . . . 0.0 108.096 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 t -122.68 148.8 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.43 1.492 . . . . 0.0 109.131 -179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' A' ' 59' ' ' LEU . 4.8 t0 -92.83 125.98 37.7 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.185 1.394 . . . . 0.0 107.468 178.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 75.6 mtp -67.87 -26.23 65.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.869 1.213 . . . . 0.0 110.605 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -63.04 -41.55 99.52 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.4 m -121.99 -1.61 9.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.588 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 60.98 27.28 17.17 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.953 1.301 . . . . 0.0 109.835 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 57' ' ' LYS . 9.3 mmpt? -103.45 154.03 19.88 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.391 1.076 . . . . 0.0 110.84 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.403 HD11 HD22 ' A' ' 49' ' ' LEU . 3.8 mm? -69.65 155.11 41.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 52' ' ' ASP . 89.6 mt -131.32 175.12 9.4 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.164 1.386 . . . . 0.0 109.726 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.9 m -113.94 -4.81 13.21 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.315 1.446 . . . . 0.0 110.68 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.6 p -152.41 154.06 34.82 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 120.393 1.452 . . . . 0.0 108.98 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -84.59 124.44 31.44 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -129.07 165.58 20.94 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.662 1.585 . . . . 0.0 108.392 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -56.08 -43.72 78.29 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.429 -0.794 . . . . 0.0 112.359 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -74.61 5.74 4.53 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.6 t -113.58 166.25 11.71 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.324 1.45 . . . . 0.0 111.034 -179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 70.8 t -143.48 123.8 9.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 126.704 2.002 . . . . 0.0 106.358 177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.8 t -80.51 144.32 32.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.39 147.26 52.55 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.5 t -118.78 103.5 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 102.361 -3.2 . . . . 0.0 102.361 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -99.05 91.76 5.17 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.17 -166.97 0.96 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -176.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 55.79 67.09 1.06 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.676 0.391 . . . . 0.0 111.716 176.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.3 mt -77.36 138.16 20.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.569 0.747 . . . . 0.0 110.632 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.406 ' CD2' ' HA ' ' A' ' 41' ' ' SER . 35.7 m-85 -137.45 169.65 17.42 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 127.175 2.19 . . . . 0.0 109.808 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -118.17 156.76 28.17 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 126.125 1.77 . . . . 0.0 108.283 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -113.01 171.05 7.77 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 126.031 1.732 . . . . 0.0 112.375 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.2 p -57.07 -37.0 71.22 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 127.309 2.244 . . . . 0.0 112.176 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -87.72 16.13 6.1 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.532 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 69.38 -1.34 2.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 126.821 2.049 . . . . 0.0 111.134 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.67 164.89 20.55 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 118.86 0.755 . . . . 0.0 109.614 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.09 144.9 41.84 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.829 1.252 . . . . 0.0 109.415 -178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.37 168.25 20.21 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.869 0.868 . . . . 0.0 109.52 178.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 38.4 ttm -134.07 143.24 47.91 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.948 1.699 . . . . 0.0 109.749 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.85 124.43 6.85 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 125.217 1.389 . . . . 0.0 110.43 179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 57.0 mt -143.13 120.92 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 53.8 44.81 29.03 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.293 1.044 . . . . 0.0 109.607 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.13 14.6 3.6 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.706 2.802 . . . . 0.0 114.327 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -116.86 147.48 42.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.722 1.609 . . . . 0.0 107.198 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -98.9 116.52 31.33 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.931 0.892 . . . . 0.0 112.527 -177.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -108.49 128.26 54.65 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.683 1.593 . . . . 0.0 109.781 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.697 ' HE2' HD21 ' A' ' 94' ' ' LEU . 7.3 ttpt -65.75 151.0 47.6 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.413 -0.804 . . . . 0.0 110.164 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.56 134.29 63.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.697 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.3 mm? -122.32 157.91 57.29 Favored Pre-proline 0 C--O 1.233 0.237 0 C-N-CA 124.023 0.929 . . . . 0.0 110.119 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.59 155.71 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.377 2.052 . . . . 0.0 110.346 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.64 -9.2 25.08 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.375 -0.828 . . . . 0.0 110.557 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 m -70.82 -8.1 50.1 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.279 2.232 . . . . 0.0 110.72 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . 0.257 0.0 OUTLIER -114.49 3.15 14.83 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -51.28 161.09 0.47 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.866 1.266 . . . . 0.0 111.784 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.33 -42.54 3.11 Favored Glycine 0 CA--C 1.522 0.519 0 O-C-N 120.926 -1.109 . . . . 0.0 111.351 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.96 53.18 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.124 1.462 . . . . 0.0 108.983 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.1 p -144.5 147.94 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 C-N-CA 126.443 1.897 . . . . 0.0 108.622 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -114.15 167.44 10.68 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.027 1.331 . . . . 0.0 108.508 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.88 166.08 20.24 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.851 0.834 . . . . 0.0 109.317 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -61.41 157.95 15.71 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 178.351 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.473 ' N ' HD12 ' A' ' 105' ' ' LEU . 41.0 ptt180 -110.45 139.46 45.65 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.005 0.922 . . . . 0.0 113.27 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.2 -28.15 69.18 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 125.976 1.71 . . . . 0.0 110.105 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -53.22 -30.31 37.23 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.006 1.722 . . . . 0.0 113.792 -178.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -70.08 -11.29 60.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.432 0.693 . . . . 0.0 109.661 -177.22 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 8.2 t80 . . . . . 0 N--CA 1.468 0.469 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -139.44 131.63 28.16 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.764 -1.21 . . . . 0.0 109.356 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.3 m -158.18 148.31 20.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 106.943 -1.502 . . . . 0.0 106.943 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 t -73.99 -175.76 2.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 1.0 . . . . 0.0 109.5 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -67.09 156.64 35.61 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.057 -1.027 . . . . 0.0 109.462 178.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -138.31 -177.37 4.81 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.563 1.945 . . . . 0.0 109.362 -178.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.74 111.37 15.47 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.088 1.355 . . . . 0.0 109.735 179.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.7 t -71.19 145.49 12.52 Favored 'Isoleucine or valine' 0 C--N 1.34 0.182 0 CA-C-N 119.193 0.906 . . . . 0.0 109.224 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.1 ttt85 -103.14 97.35 7.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.5 145.0 41.72 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.922 -2.251 . . . . 0.0 104.922 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.24 -25.44 63.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 118.398 -0.81 . . . . 0.0 112.701 -179.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 66.78 142.79 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.671 2.389 . . . . 0.0 112.901 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 50.99 28.03 15.89 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.249 0.928 . . . . 0.0 112.928 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.6 p -137.28 177.89 7.51 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 125.305 1.442 . . . . 0.0 110.931 -178.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -74.79 -168.9 0.79 Allowed 'General case' 0 C--O 1.239 0.54 0 C-N-CA 127.173 2.189 . . . . 0.0 107.701 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . 0.251 7.7 p -79.61 120.21 23.63 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 120.43 -1.419 . . . . 0.0 107.248 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -168.18 148.21 4.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 131.649 3.98 . . . . 0.0 104.712 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -172.68 165.57 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 mm -117.87 135.9 56.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 122.027 0.918 . . . . 0.0 108.642 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -149.09 142.74 25.48 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.221 -1.809 . . . . 0.0 108.962 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.3 t0 51.85 33.61 11.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.871 1.268 . . . . 0.0 110.863 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 55.57 29.12 12.9 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 127.573 2.349 . . . . 0.0 112.463 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -124.6 144.01 50.4 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 m -81.88 114.43 20.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -117.76 165.7 13.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.722 2.009 . . . . 0.0 111.879 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -150.33 173.89 13.48 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.175 1.39 . . . . 0.0 109.576 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.49 128.55 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 p -90.02 163.88 14.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.943 1.297 . . . . 0.0 113.584 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -75.74 -16.78 60.09 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.221 1.809 . . . . 0.0 112.737 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -75.18 136.94 41.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.602 1.561 . . . . 0.0 106.893 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.515 ' C ' HD12 ' A' ' 33' ' ' ILE . 42.3 tt0 -118.9 147.32 44.12 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.708 1.603 . . . . 0.0 111.095 -178.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.515 HD12 ' C ' ' A' ' 32' ' ' GLU . 1.5 mp -118.46 136.88 24.24 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.605 1.562 . . . . 0.0 107.432 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -79.02 156.87 26.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 124.615 3.543 . . . . 0.0 112.136 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -57.95 -28.47 64.35 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.811 0.844 . . . . 0.0 111.737 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -67.13 -14.42 62.89 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.07 -1.019 . . . . 0.0 112.119 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -104.08 -8.31 19.6 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.609 1.164 . . . . 0.0 110.889 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.65 132.38 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.703 1.601 . . . . 0.0 108.668 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -83.63 -56.09 3.92 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.572 1.149 . . . . 0.0 110.445 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.08 170.09 9.04 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.713 1.605 . . . . 0.0 109.412 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.8 p -68.97 174.03 4.86 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.7 tttp -138.92 -39.02 0.5 Allowed 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.179 -0.951 . . . . 0.0 112.407 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -149.34 117.55 0.93 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.714 0.806 . . . . 0.0 109.043 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.95 124.22 33.48 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 104.322 -2.473 . . . . 0.0 104.322 176.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.69 157.18 42.66 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 128.417 2.687 . . . . 0.0 105.312 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -140.59 109.7 6.14 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.413 1.085 . . . . 0.0 110.332 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -144.18 139.72 28.92 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.2 tt -137.28 144.74 42.84 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 127.696 2.398 . . . . 0.0 108.256 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -154.47 169.55 23.52 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 61.9 mt -131.07 134.02 62.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 t -122.88 143.11 36.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.468 1.107 . . . . 0.0 108.282 -179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.08 123.86 28.74 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 106.388 -1.708 . . . . 0.0 106.388 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtp -68.24 -21.85 64.81 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 120.287 1.403 . . . . 0.0 114.018 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -74.27 -53.57 9.48 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.856 0.753 . . . . 0.0 110.364 -179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.8 m -91.92 -15.87 27.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.54 30.76 19.99 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 126.545 1.938 . . . . 0.0 111.798 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -115.59 161.09 19.13 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.633 1.173 . . . . 0.0 109.257 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.34 149.45 44.39 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.193 0.52 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 mt -129.19 173.05 10.84 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.33 1.852 . . . . 0.0 107.786 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 t -118.66 12.72 13.16 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.255 1.022 . . . . 0.0 111.512 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.5 p -159.07 157.75 31.7 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.827 1.194 . . . . 0.0 109.28 -179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.1 t -89.7 119.91 30.51 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.948 0.899 . . . . 0.0 110.098 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -130.72 160.12 35.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.314 1.045 . . . . 0.0 109.473 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -51.8 -20.72 2.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -104.32 5.71 34.73 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.807 1.639 . . . . 0.0 111.161 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 21.1 m -115.55 165.74 12.67 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 124.95 1.3 . . . . 0.0 111.203 -177.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 53.8 t -140.57 144.5 27.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 124.515 1.126 . . . . 0.0 108.259 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.1 t -87.48 143.37 27.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.761 1.224 . . . . 0.0 108.89 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.0 mt -136.78 122.88 20.34 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.9 t -104.88 103.29 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 103.556 -2.757 . . . . 0.0 103.556 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -93.02 97.48 10.74 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.94 -172.92 2.2 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.22 68.96 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.939 1.696 . . . . 0.0 114.79 177.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.8 mt -71.03 141.14 17.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.73 1.612 . . . . 0.0 109.223 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -131.44 169.43 16.06 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.171 1.788 . . . . 0.0 109.341 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -114.85 152.79 31.6 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.207 1.403 . . . . 0.0 107.546 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -104.09 160.74 14.59 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 124.947 1.299 . . . . 0.0 109.824 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -65.07 -24.68 67.53 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.238 178.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -85.7 12.85 8.04 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 126.588 1.955 . . . . 0.0 110.662 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 69.75 -1.82 2.19 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.917 2.087 . . . . 0.0 110.524 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.0 m -70.97 168.69 16.45 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.4 148.8 45.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.909 0.884 . . . . 0.0 111.177 -178.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 21.1 p -141.94 172.06 13.2 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.151 0.98 . . . . 0.0 111.019 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.4 ttm -133.05 139.71 47.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 126.121 1.768 . . . . 0.0 109.365 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.59 124.3 6.64 Favored Glycine 0 C--N 1.338 0.651 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 58.5 mt -141.98 123.03 12.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 49.27 44.89 23.61 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.573 1.149 . . . . 0.0 110.871 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.6 t0 67.11 4.27 3.54 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.961 2.905 . . . . 0.0 116.142 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -111.81 145.89 38.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.903 1.281 . . . . 0.0 108.907 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -98.86 117.91 34.43 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 123.034 0.534 . . . . 0.0 111.656 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -105.95 132.15 52.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.685 1.194 . . . . 0.0 107.808 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.625 ' HE2' HD21 ' A' ' 94' ' ' LEU . 1.4 ttpm? -72.1 158.54 35.75 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 118.596 -1.242 . . . . 0.0 110.336 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.63 133.56 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.625 HD21 ' HE2' ' A' ' 92' ' ' LYS . 4.5 mm? -127.04 163.51 41.18 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 125.991 1.716 . . . . 0.0 110.736 -177.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.76 143.3 26.6 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 122.296 1.997 . . . . 0.0 107.859 178.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -12.64 20.29 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.3 m -65.77 -13.81 60.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -76.1 -1.24 25.11 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.362 1.065 . . . . 0.0 112.382 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -50.46 149.77 2.96 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.506 1.122 . . . . 0.0 109.273 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.62 -42.33 2.91 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 108.546 -1.821 . . . . 0.0 108.546 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -89.45 -39.56 13.28 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.568 0.747 . . . . 0.0 108.986 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -130.44 170.79 18.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 125.798 1.639 . . . . 0.0 109.6 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -145.25 166.34 25.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.469 2.308 . . . . 0.0 108.186 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.42 174.24 5.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.445 0.641 . . . . 0.0 110.792 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.292 0.4 OUTLIER -68.99 176.17 3.3 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -179.134 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ptp85 -129.92 141.47 50.78 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 125.157 1.383 . . . . 0.0 112.229 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.0 mp -71.63 -17.95 62.23 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.248 0.619 . . . . 0.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -57.8 -26.53 62.08 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.082 1.753 . . . . 0.0 113.484 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 -76.63 -9.43 58.66 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.772 0.829 . . . . 0.0 110.446 -178.33 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 121.574 0.702 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -161.27 158.27 26.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.474 1.91 . . . . 0.0 107.206 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.4 m 53.68 78.55 0.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.621 1.568 . . . . 0.0 109.811 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 84.4 p -137.48 97.0 3.36 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -70.35 114.56 8.6 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -142.12 179.16 7.06 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.267 1.827 . . . . 0.0 107.93 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 tptt -147.72 161.33 41.42 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.2 t -119.78 139.92 45.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 120.707 1.594 . . . . 0.0 108.798 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -107.18 118.41 36.65 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -84.66 175.42 9.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -80.84 -34.13 34.04 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 127.417 2.287 . . . . 0.0 110.459 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 54.13 127.64 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 128.465 2.706 . . . . 0.0 115.042 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.98 25.23 61.57 Favored Glycine 0 CA--C 1.533 1.2 0 O-C-N 121.363 -0.836 . . . . 0.0 112.577 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.2 m -140.49 -179.62 6.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 126.95 2.1 . . . . 0.0 110.785 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -73.69 -171.06 0.96 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.491 1.516 . . . . 0.0 109.005 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.7 p -80.53 120.76 24.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 119.511 -1.993 . . . . 0.0 111.626 -175.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -167.16 154.9 9.21 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.44 3.896 . . . . 0.0 105.294 178.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 49.0 p90 -170.11 173.49 5.88 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.693 1.588 . . . . 0.0 107.437 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.1 mt -131.58 119.01 41.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 O-C-N 120.529 -1.357 . . . . 0.0 107.496 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -129.38 137.8 51.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.28 34.12 22.13 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.796 1.239 . . . . 0.0 111.438 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.7 m120 62.98 14.99 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.452 2.701 . . . . 0.0 112.931 -178.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.8 mtpp -111.62 132.94 54.22 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.8 m -76.32 129.06 36.08 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 7.0 m-85 -132.84 164.1 27.63 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 126.603 1.961 . . . . 0.0 110.516 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -149.25 159.37 44.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.513 0.725 . . . . 0.0 109.442 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 t -89.72 132.23 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.4 p -102.04 166.3 10.69 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.732 1.213 . . . . 0.0 110.091 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.1 -7.69 55.32 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.342 1.057 . . . . 0.0 112.122 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -71.28 114.22 9.12 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -101.99 144.11 31.01 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.07 140.01 23.69 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.863 2.065 . . . . 0.0 108.403 -179.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.77 156.15 39.56 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 123.016 2.477 . . . . 0.0 109.89 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.53 -29.47 69.14 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.12 -19.5 65.63 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.074 0.55 . . . . 0.0 111.936 179.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -93.17 -13.57 28.24 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.592 0.757 . . . . 0.0 110.28 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 65.7 t -75.2 123.5 31.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.423 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.3 OUTLIER -80.24 -61.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.441 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.44 163.99 38.79 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.253 -0.904 . . . . 0.0 112.351 -178.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 m -65.5 137.26 57.31 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.601 1.56 . . . . 0.0 107.152 178.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' OE2' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -112.29 -53.87 2.67 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.883 -177.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.1 t -141.01 134.39 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 119.814 1.188 . . . . 0.0 112.547 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.3 mtpt -103.53 110.21 22.16 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -145.05 156.75 44.1 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.445 2.698 . . . . 0.0 106.493 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -128.31 113.18 15.3 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.844 0.857 . . . . 0.0 110.723 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -148.88 134.41 18.63 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.954 0.797 . . . . 0.0 110.468 178.263 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.478 ' O ' ' HE3' ' A' ' 47' ' ' LYS . 9.0 tt -138.32 145.04 40.69 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 125.85 1.66 . . . . 0.0 108.283 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HE2' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -148.75 170.39 18.32 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.099 1.36 . . . . 0.0 107.402 179.266 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.431 ' O ' HD13 ' A' ' 58' ' ' LEU . 50.9 mt -129.48 132.21 66.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.3 t -126.72 139.74 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 124.649 1.18 . . . . 0.0 109.458 -178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -85.99 128.36 34.83 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 121.309 -0.87 . . . . 0.0 109.406 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 46.9 mtp -68.64 -19.44 64.42 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.6 mttm -77.16 -46.85 22.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.519 1.509 . . . . 0.0 111.952 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.0 p -105.2 -6.06 20.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 63.88 18.81 11.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.695 1.198 . . . . 0.0 110.378 -179.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -101.72 159.91 14.91 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.342 0.974 . . . . 0.0 111.739 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ILE . 3.8 mm? -73.2 145.76 46.03 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.415 -179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 mt -126.6 166.32 17.53 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.893 2.077 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.83 -33.55 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 118.078 -0.963 . . . . 0.0 109.612 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.5 m -130.02 150.01 51.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.461 1.104 . . . . 0.0 109.551 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.92 111.09 17.79 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.495 0.718 . . . . 0.0 110.506 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -101.8 168.69 9.28 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 177.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -58.11 -32.66 68.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 -78.53 -3.05 41.73 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.071 0.948 . . . . 0.0 110.445 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.4 t -114.58 161.66 17.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.393 1.477 . . . . 0.0 113.219 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 86.3 t -133.88 146.46 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 126.125 1.77 . . . . 0.0 108.431 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.7 t -84.29 144.19 29.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.966 1.306 . . . . 0.0 109.554 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.7 mt -135.37 122.53 21.53 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 120.865 -1.147 . . . . 0.0 108.162 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.443 HG22 HD12 ' A' ' 48' ' ' LEU . 3.5 t -106.71 103.41 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -99.36 96.64 7.85 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.124 -1.806 . . . . 0.0 106.124 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.22 -168.91 0.78 Allowed 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 50.06 68.31 0.77 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.88 1.272 . . . . 0.0 112.912 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.74 145.33 11.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.638 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -135.87 169.01 18.26 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.926 2.09 . . . . 0.0 109.064 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.424 ' OE2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 tt0 -119.16 149.66 41.35 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.482 1.513 . . . . 0.0 107.071 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.56 166.58 10.64 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.593 1.557 . . . . 0.0 110.255 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.2 p -61.2 -29.95 70.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.911 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -101.58 29.47 4.85 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.995 1.718 . . . . 0.0 112.885 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 65.76 -0.82 1.19 Allowed 'General case' 0 C--O 1.238 0.458 0 C-N-CA 126.631 1.972 . . . . 0.0 114.055 178.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -67.15 158.89 30.12 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.0 mt -115.62 144.43 43.91 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 27.1 p -138.76 164.88 28.44 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 53.8 ttm -127.7 137.35 52.45 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.317 1.847 . . . . 0.0 109.524 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.44 117.94 4.52 Favored Glycine 0 CA--C 1.521 0.438 0 C-N-CA 124.71 1.148 . . . . 0.0 110.393 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.8 mt -134.83 118.79 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 125.505 1.522 . . . . 0.0 107.101 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 49.94 47.21 23.56 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.481 1.113 . . . . 0.0 109.754 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 65.18 9.38 5.53 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.165 2.186 . . . . 0.0 114.733 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -115.48 136.95 52.56 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.164 1.386 . . . . 0.0 108.737 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -92.64 117.35 29.88 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.97 -0.456 . . . . 0.0 111.156 -179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 132.17 52.08 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.135 -0.978 . . . . 0.0 108.778 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 147.54 51.66 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -115.62 132.62 64.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -124.32 157.38 64.86 Favored Pre-proline 0 N--CA 1.47 0.562 0 C-N-CA 124.824 1.25 . . . . 0.0 108.775 -178.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -69.9 154.39 67.24 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.659 2.239 . . . . 0.0 109.685 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -61.04 -15.19 29.51 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.808 0.337 . . . . 0.0 111.631 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.3 p -80.05 -7.73 59.01 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 112.242 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -87.5 -9.58 54.14 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.696 1.598 . . . . 0.0 112.14 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.51 161.83 0.93 Allowed 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.728 1.211 . . . . 0.0 113.492 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.78 -42.59 2.65 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 107.941 -2.064 . . . . 0.0 107.941 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.18 -27.62 22.92 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.194 0.998 . . . . 0.0 109.396 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.6 p -132.6 166.64 28.69 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 C-N-CA 125.554 1.542 . . . . 0.0 109.882 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -135.94 165.19 26.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.841 2.456 . . . . 0.0 107.363 178.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.98 178.93 0.58 Allowed 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.452 0.644 . . . . 0.0 111.083 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.578 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -70.9 170.23 13.1 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.822 -0.549 . . . . 0.0 109.721 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.578 ' N ' HD12 ' A' ' 105' ' ' LEU . 88.2 mtt180 -126.02 142.18 51.63 Favored 'General case' 0 CA--C 1.52 -0.199 0 O-C-N 121.166 -0.959 . . . . 0.0 110.11 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.4 mp -71.4 -17.24 62.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.766 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.68 -18.07 61.74 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -73.15 -13.93 61.27 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.679 0.672 . . . . 0.0 111.784 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 C--O 1.248 0.988 0 C-N-CA 126.369 1.867 . . . . 0.0 110.342 -177.543 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 . . . . . 0 N--CA 1.474 0.775 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 75.5 41.41 0.27 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 128.13 2.572 . . . . 0.0 115.064 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.16 137.4 41.31 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.5 m -151.39 121.38 7.13 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.156 1.383 . . . . 0.0 107.982 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -129.72 120.11 24.58 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.983 1.313 . . . . 0.0 109.061 -179.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -162.73 152.74 16.14 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.658 -1.276 . . . . 0.0 110.803 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -67.86 163.76 21.2 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.4 t -116.44 160.27 15.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.039 1.335 . . . . 0.0 108.608 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -128.46 107.69 9.93 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 102.821 -3.029 . . . . 0.0 102.821 178.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -82.36 166.63 19.29 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.48 -33.98 76.9 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 119.158 0.89 . . . . 0.0 110.801 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 55.66 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.606 1.962 . . . . 0.0 113.424 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.51 7.3 51.71 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.819 1.199 . . . . 0.0 112.477 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.4 m -131.96 179.31 6.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.112 1.765 . . . . 0.0 110.031 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -73.4 -169.74 0.7 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 127.118 2.167 . . . . 0.0 107.778 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 41.0 p -80.71 120.31 24.44 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 120.068 -1.645 . . . . 0.0 111.708 -176.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -168.82 147.12 3.99 Favored 'General case' 0 CA--C 1.54 0.573 1 C-N-CA 133.622 4.769 . . . . 0.0 103.224 177.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 26' ' ' TYR . 44.9 p90 -165.55 169.17 15.74 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 125.311 1.444 . . . . 0.0 107.83 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 20' ' ' ILE . 2.5 mp -123.52 123.02 66.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 O-C-N 120.472 -1.393 . . . . 0.0 108.014 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -133.09 139.2 47.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t70 54.03 33.23 17.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.506 1.522 . . . . 0.0 112.626 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 65.27 24.02 12.19 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.33 1.452 . . . . 0.0 110.486 -179.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -125.13 137.23 54.17 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.34 144.59 40.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.545 -2.021 . . . . 0.0 105.545 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 19' ' ' PHE . 2.6 m-85 -147.99 167.45 24.88 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 127.032 2.133 . . . . 0.0 110.472 -177.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -150.02 171.29 17.08 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.041 0.937 . . . . 0.0 108.761 177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.96 127.53 58.05 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 p -94.9 169.19 10.31 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.467 1.107 . . . . 0.0 110.472 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.24 -15.52 58.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.937 1.295 . . . . 0.0 112.817 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 111.96 6.38 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.333 0.653 . . . . 0.0 111.196 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 -93.6 140.18 29.91 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.438 HD13 ' HB2' ' A' ' 92' ' ' LYS . 1.7 mp -111.67 141.32 24.43 Favored Pre-proline 0 N--CA 1.466 0.358 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.65 151.47 41.45 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.7 1.6 . . . . 0.0 111.194 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -53.97 -29.06 41.3 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 125.737 1.615 . . . . 0.0 113.263 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -69.89 -29.09 66.2 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 123.289 0.636 . . . . 0.0 110.864 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.91 -15.57 44.03 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.797 0.839 . . . . 0.0 110.666 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.32 138.8 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.539 HD22 ' C ' ' A' ' 39' ' ' ASN . 0.2 OUTLIER -92.8 -61.57 1.56 Allowed 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.266 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.34 166.49 18.61 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.086 0.857 . . . . 0.0 112.245 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.7 m -63.69 138.76 58.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.599 1.16 . . . . 0.0 109.069 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -116.27 -36.34 4.07 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -148.76 142.8 18.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -117.83 102.34 9.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -135.67 157.81 45.94 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 130.419 3.488 . . . . 0.0 106.577 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -141.45 110.45 6.21 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.103 1.361 . . . . 0.0 107.608 179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -141.1 125.53 17.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.0 tt -125.34 144.39 50.52 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.555 1.542 . . . . 0.0 107.749 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -153.45 169.95 21.92 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 108.948 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.571 ' O ' HD13 ' A' ' 58' ' ' LEU . 31.8 mt -124.29 138.41 53.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 125.613 1.565 . . . . 0.0 106.785 -179.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.6 t -132.77 124.82 51.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.429 1.092 . . . . 0.0 109.977 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -62.19 121.65 13.62 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.664 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.3 mtp -68.2 -18.24 64.53 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 120.71 1.596 . . . . 0.0 112.546 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -84.18 -25.69 29.36 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 m -122.35 -13.43 8.06 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.273 0.629 . . . . 0.0 111.802 -178.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 63.65 21.27 12.63 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.605 1.562 . . . . 0.0 109.901 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -105.18 153.15 21.94 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.61 1.164 . . . . 0.0 110.783 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 49' ' ' LEU . 2.2 mm? -67.34 148.22 51.93 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.958 0.903 . . . . 0.0 110.856 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.5 mt -136.04 177.28 7.96 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.004 1.722 . . . . 0.0 109.392 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.3 p -105.65 -30.36 9.53 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.144 1.377 . . . . 0.0 111.088 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -122.03 151.89 40.35 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.005 0.82 . . . . 0.0 110.802 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 t -89.07 93.28 9.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.243 0.617 . . . . 0.0 109.551 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.69 164.39 18.63 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -57.33 -34.24 68.55 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -80.72 5.39 15.88 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.642 -0.661 . . . . 0.0 111.584 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.4 t -113.42 177.99 4.44 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.201 1.4 . . . . 0.0 111.634 -178.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 p -145.85 159.19 12.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 126.686 1.994 . . . . 0.0 107.419 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -111.23 143.14 42.46 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.0 mt -131.33 150.87 51.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.7 t -127.86 102.65 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -86.14 92.03 8.61 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 104.796 -2.298 . . . . 0.0 104.796 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.29 -173.02 3.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 47.3 67.63 0.77 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.874 1.67 . . . . 0.0 112.882 177.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mt -77.9 141.81 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 O-C-N 121.177 -0.952 . . . . 0.0 109.498 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -140.87 166.11 25.69 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.942 1.697 . . . . 0.0 110.039 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -110.9 158.04 19.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.918 2.087 . . . . 0.0 106.952 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -115.94 168.78 9.77 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.544 1.138 . . . . 0.0 112.27 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.0 t -58.06 -35.89 72.0 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.91 178.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -84.89 21.13 1.65 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.684 1.193 . . . . 0.0 111.785 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.8 mptt 59.1 19.68 7.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.306 1.443 . . . . 0.0 110.721 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.543 ' HB3' ' HE2' ' A' ' 92' ' ' LYS . 63.3 m -79.69 168.68 19.03 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mt -125.46 143.59 50.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 29.5 p -147.84 168.64 21.68 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.608 0.763 . . . . 0.0 110.837 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.0 ttm -135.23 139.54 44.56 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.181 1.792 . . . . 0.0 109.733 -178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -84.5 125.1 6.98 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.9 mt -138.72 124.42 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 52.07 42.53 30.55 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.826 0.822 . . . . 0.0 109.004 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 60.44 20.86 10.52 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.834 2.054 . . . . 0.0 114.105 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 -122.07 137.66 54.73 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.712 1.605 . . . . 0.0 108.477 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -93.27 116.32 28.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -106.52 129.83 54.41 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.536 1.135 . . . . 0.0 110.754 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.543 ' HE2' ' HB3' ' A' ' 81' ' ' SER . 51.1 tttm -64.28 145.36 56.14 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.621 -0.674 . . . . 0.0 109.878 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.52 133.09 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -120.13 156.64 54.6 Favored Pre-proline 0 C--O 1.238 0.468 0 C-N-CA 124.128 0.971 . . . . 0.0 109.342 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.02 141.88 54.61 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 N-CA-C 106.726 -2.067 . . . . 0.0 106.726 179.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -22.1 37.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.673 -0.642 . . . . 0.0 111.668 -179.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 t -66.16 -13.17 59.75 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.129 179.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -3.16 43.56 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 120.563 1.529 . . . . 0.0 114.098 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -50.85 162.01 0.31 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.24 1.416 . . . . 0.0 113.794 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.84 -43.65 2.98 Favored Glycine 0 CA--C 1.521 0.442 0 C-N-CA 127.074 2.274 . . . . 0.0 110.969 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.89 -22.54 45.8 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 p -133.05 159.23 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 C-N-CA 130.78 3.632 . . . . 0.0 106.1 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -135.6 169.42 17.56 Favored 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 123.461 0.704 . . . . 0.0 109.953 179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.84 160.29 17.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.71 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.527 HD12 ' N ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -59.2 158.6 8.72 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.937 0.875 . . . . 0.0 112.774 -178.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.527 ' N ' HD12 ' A' ' 105' ' ' LEU . 9.4 mtt85 -109.94 119.24 38.7 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 124.744 1.217 . . . . 0.0 108.551 -179.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -9.35 43.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.937 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.62 -22.12 66.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.452 1.101 . . . . 0.0 110.959 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -70.24 -9.04 54.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.646 1.178 . . . . 0.0 113.356 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 125.018 1.327 . . . . 0.0 110.178 -178.078 . . . . . . . . 0 0 . 1 stop_ save_