data_1jw2_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 1jw2 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.784 0.326 . . . . 0.0 110.805 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -54.05 -27.19 30.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.037 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.2 t -78.19 -35.05 49.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.84 -50.41 73.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.841 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.415 ' HB2' ' CG1' ' A' ' 42' ' ' VAL . 1.3 m-85 -74.45 -43.73 54.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 110.406 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.06 -43.7 78.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.812 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.68 93.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.713 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 -24.39 58.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.085 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.72 -45.79 77.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.142 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -68.12 -17.95 64.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.243 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -56.26 -22.45 30.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.245 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.8 p -50.74 176.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -102.4 -34.05 9.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.4 t -153.03 164.6 37.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.7 mm -74.5 -41.58 49.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.425 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.23 -48.24 71.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.173 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.08 -40.88 37.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.22 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.442 ' O ' ' CG1' ' A' ' 27' ' ' VAL . 1.4 tm? -60.33 -38.04 82.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.14 -39.12 77.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.073 0.463 . . . . 0.0 110.528 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -59.06 -37.13 76.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.87 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.442 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 6.4 p -74.26 -26.44 20.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 24' ' ' LEU . 23.4 mt -60.42 -38.72 78.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.108 0.48 . . . . 0.0 110.234 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -70.53 -46.2 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.693 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -47.54 73.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -62.12 -34.11 75.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 -41.29 88.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -90.9 -21.79 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -72.62 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.132 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.569 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -67.3 -156.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.158 0.504 . . . . 0.0 111.421 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m -118.66 -178.21 3.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.242 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.91 -25.22 64.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -73.19 -48.06 38.39 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.569 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -79.58 -29.72 41.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.242 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 ' HB2' ' CD2' ' A' ' 35' ' ' LEU . 6.5 tt -61.35 -36.22 79.59 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.028 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.86 -37.41 68.73 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.415 ' CG1' ' HB2' ' A' ' 11' ' ' TYR . 12.5 t -77.04 -30.69 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.581 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -75.89 -37.98 58.27 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.829 0.347 . . . . 0.0 111.249 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.81 -48.11 48.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 96.8 p -62.11 -33.11 73.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.21 -37.72 57.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.173 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.94 -28.23 69.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.219 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -75.03 -46.27 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.052 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -42.25 71.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 109.84 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -48.11 73.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.329 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.426 HD13 ' CH2' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.93 -37.03 73.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.919 179.314 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.435 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -61.1 -51.1 70.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 60' ' ' TYR . 7.7 pt-20 -64.4 -29.6 70.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.624 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.7 mp -59.91 -35.29 74.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.917 0.389 . . . . 0.0 110.25 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 74.4 m -82.11 -34.81 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.475 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.4 tpp -96.52 20.08 11.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.993 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 1.4 m-20 77.45 -72.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.173 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER -151.23 34.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.666 0.269 . . . . 0.0 111.211 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -117.22 117.99 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 0.0 111.47 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.484 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.1 p90 -134.93 161.13 36.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.674 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 10.3 t0 88.1 -25.27 0.09 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.23 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.12 19.5 14.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.907 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.44 HG21 ' CD1' ' A' ' 68' ' ' TRP . 2.2 mp -63.39 119.42 53.11 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.786 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.88 -167.79 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.448 2.099 . . . . 0.0 112.352 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.0 p -88.72 -26.45 21.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.1 m -71.27 -46.36 61.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.098 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.64 -48.64 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.44 ' CD1' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -60.61 -44.42 96.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.733 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -56.51 -27.75 58.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.91 -50.16 15.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.264 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.3 tt . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.891 0.376 . . . . 0.0 111.42 -179.682 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -30.0 68.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.066 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.43 -29.38 41.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.16 -50.33 70.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.084 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.83 -43.16 59.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.838 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' A' ' 49' ' ' HIS . 1.5 tp -55.35 -41.48 72.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.987 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.407 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.39 -42.49 59.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.078 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.04 -39.14 89.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.99 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.49 -44.7 93.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -74.85 -25.54 59.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.969 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -56.68 -22.46 35.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.288 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.4 173.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.775 0.322 . . . . 0.0 111.145 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -101.38 -38.08 8.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.183 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.401 HG23 ' HB ' ' A' ' 23' ' ' THR . 13.3 t -140.85 159.96 41.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.1 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.3 mm -74.49 -37.76 44.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.345 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -53.98 -50.94 65.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.401 ' HB ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -72.96 -30.37 63.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.905 0.383 . . . . 0.0 110.514 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.457 ' O ' ' CG1' ' A' ' 27' ' ' VAL . 1.5 tm? -70.26 -39.13 75.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.663 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -58.03 -39.31 78.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.102 0.477 . . . . 0.0 110.533 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -35.03 71.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.728 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.457 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 5.8 p -77.47 -26.41 15.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.093 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.428 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 35.9 mt -59.18 -39.01 77.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.977 0.417 . . . . 0.0 110.42 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.54 -43.53 55.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.821 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 mmtp -65.69 -47.6 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.454 ' CB ' ' CE2' ' A' ' 43' ' ' PHE . 2.6 m120 -68.38 -31.7 71.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.084 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -36.16 78.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.084 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.35 -22.01 16.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.407 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER -57.55 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.227 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.546 ' C ' ' CD2' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.93 -156.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.229 0.538 . . . . 0.0 111.553 -179.75 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.8 m -118.67 -178.24 3.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.128 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -59.55 -25.01 64.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.88 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -73.15 -48.32 36.51 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -79.7 -30.31 40.98 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.412 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.99 -35.03 70.63 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.834 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -30.88 62.14 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 47.0 t -76.78 -33.4 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.23 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 31' ' ' ASN . 9.9 t80 -75.87 -43.25 46.46 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.955 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -42.29 98.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.831 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.5 p -58.38 -46.0 87.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.813 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.69 68.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.998 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.09 -47.19 85.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.58 -48.67 76.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.412 ' CD2' HD13 ' A' ' 12' ' ' LEU . 28.9 t60 -60.02 -45.38 92.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -64.75 -48.13 75.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.661 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -30.67 69.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.696 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.447 ' HB2' HG12 ' A' ' 63' ' ' ILE . . . -61.46 -51.58 68.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.315 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.519 ' N ' ' HB2' ' A' ' 59' ' ' LEU . 2.1 tm-20 -64.4 -26.88 68.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.66 -179.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.0 mt -78.36 -36.58 45.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 m -82.97 -43.4 16.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -178.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.415 ' CB ' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.61 3.49 16.71 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.431 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.467 ' HA ' ' O ' ' A' ' 53' ' ' GLU . 2.1 t30 63.88 126.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.815 0.34 . . . . 0.0 110.581 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.434 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 0.4 OUTLIER 49.47 86.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.02 0.438 . . . . 0.0 110.805 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.519 ' HB2' ' N ' ' A' ' 53' ' ' GLU . 4.1 mm? -119.79 148.62 43.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.666 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.546 ' O ' ' CD1' ' A' ' 63' ' ' ILE . 31.1 m-85 -83.07 161.08 21.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.913 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -61.56 -17.07 53.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.446 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.71 78.43 1.85 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.806 0.336 . . . . 0.0 111.572 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.546 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 1.3 mp -68.41 136.05 90.96 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.651 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.27 -157.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.473 2.115 . . . . 0.0 112.208 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 t -99.44 -34.11 10.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.2 m -59.99 -46.18 90.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.7 t -61.37 -45.55 98.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.042 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.554 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -66.8 -23.63 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.148 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -28.59 62.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.034 179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -76.39 -50.32 14.5 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.805 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.506 HD11 HG21 ' A' ' 71' ' ' ILE . 7.4 pt . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.762 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.902 0.382 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -34.5 71.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.41 -30.04 42.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.055 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -61.92 -50.35 72.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.187 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -68.18 -51.95 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.878 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.37 -45.04 76.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.047 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -45.32 71.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.919 0.39 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -29.52 70.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.905 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -45.96 89.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.053 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -67.86 -16.87 64.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.274 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -53.95 -24.66 17.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.43 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.74 168.76 4.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.876 0.369 . . . . 0.0 111.105 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -41.76 6.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.951 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.431 HG21 ' HB ' ' A' ' 23' ' ' THR . 12.8 t -129.16 150.72 50.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.783 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' NH2' ' A' ' 50' ' ' ARG . 39.0 mm -67.56 -39.61 82.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.767 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.99 -51.03 65.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.665 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.431 ' HB ' HG21 ' A' ' 20' ' ' THR . 1.0 OUTLIER -74.61 -29.42 61.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.436 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.402 HD21 HG11 ' A' ' 27' ' ' VAL . 3.0 tt -69.76 -38.66 76.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.587 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.48 -30.15 64.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.041 0.448 . . . . 0.0 110.456 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -60.26 -33.09 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.402 HG11 HD21 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -77.06 -31.36 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.079 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.402 ' CD1' ' CD2' ' A' ' 24' ' ' LEU . 1.7 mp -59.15 -33.31 50.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 110.194 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.78 -49.0 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.949 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -33.08 72.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -74.3 -42.46 59.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.26 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HG3' ' N ' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -59.85 -30.16 68.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.892 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.437 ' N ' ' HG3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -98.72 -5.74 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.409 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -70.16 0.52 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.797 0.332 . . . . 0.0 111.232 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.26 -160.42 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.285 0.564 . . . . 0.0 111.97 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -119.17 -178.03 3.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.164 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.65 -25.29 66.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.378 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -72.36 -47.49 49.17 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.733 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 1.9 tp10 -78.79 -29.67 45.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.928 0.394 . . . . 0.0 110.201 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.17 -31.21 65.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.715 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.02 -32.4 63.96 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 72.4 t -76.84 -32.79 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.042 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -75.94 -42.63 48.13 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.868 0.366 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.48 -48.13 68.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.1 t -58.87 -46.52 87.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.853 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.02 -28.57 64.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.149 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.31 -66.34 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.334 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -54.94 -43.66 73.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.183 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -51.6 67.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.837 0.351 . . . . 0.0 110.459 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.413 ' NH2' ' CD1' ' A' ' 21' ' ' ILE . 0.7 OUTLIER -61.24 -40.75 95.21 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.119 0.485 . . . . 0.0 109.955 179.161 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.71 -34.8 78.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.159 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.419 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -65.34 -51.04 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.15 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.7 pt-20 -56.93 -41.89 79.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.859 0.361 . . . . 0.0 110.465 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.12 -29.04 65.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.205 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.7 m -82.34 -36.01 27.29 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.092 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.458 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 11.4 mmm -93.12 17.96 10.09 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 m120 64.38 62.71 0.8 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.962 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? 64.71 27.23 13.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.977 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 56' ' ' MET . 1.0 OUTLIER -119.96 121.51 39.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.94 0.4 . . . . 0.0 111.372 179.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.479 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 4.4 p90 -126.35 161.47 27.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.563 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 1.1 t70 87.7 -7.75 0.59 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.027 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -128.6 13.62 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.704 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.433 HG22 ' CD1' ' A' ' 68' ' ' TRP . 1.8 mp -65.2 118.2 47.44 Favored Pre-proline 0 C--N 1.333 -0.127 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.903 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.25 -168.17 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.407 2.071 . . . . 0.0 112.22 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -92.34 -28.61 16.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.6 m -68.39 -46.2 70.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 23.3 t -69.19 -49.43 61.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.105 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.455 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.65 -40.58 79.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -63.03 -30.89 71.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.779 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -70.9 -50.18 37.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.4 tt . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.064 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.832 0.348 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -59.14 -38.88 80.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.742 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -42.79 85.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.003 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.1 -50.37 69.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.007 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.6 -44.26 35.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.971 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -55.38 -47.32 76.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.293 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -69.72 -31.17 69.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.777 0.323 . . . . 0.0 110.935 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -77.9 -29.69 50.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.023 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.28 -45.81 79.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.077 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -18.03 63.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -23.65 19.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.26 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -173.1 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -102.29 -39.93 6.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.6 t -139.2 150.64 45.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.101 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.3 mp -74.63 -32.49 29.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.864 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -55.87 -50.96 69.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.425 ' CG2' ' N ' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -63.47 -45.46 90.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.494 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.474 ' O ' HG13 ' A' ' 27' ' ' VAL . 1.9 mt -56.04 -31.49 63.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -39.85 79.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.091 0.472 . . . . 0.0 109.823 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -48.18 77.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.23 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 24' ' ' LEU . 3.8 p -71.75 -23.85 22.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 tp -59.16 -38.48 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.337 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -43.51 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.691 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -64.64 -47.45 78.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.433 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 1.1 t-20 -59.01 -34.61 72.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.903 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -58.63 -47.22 85.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.656 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -88.54 -7.09 57.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.123 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -74.55 -67.62 0.61 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.128 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.559 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.23 -155.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.193 0.521 . . . . 0.0 111.388 -179.804 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.9 t -118.56 -178.25 3.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.168 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.0 -25.08 64.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.837 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -72.76 -48.26 39.88 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.559 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -79.79 -29.83 40.47 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.513 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.93 -36.72 75.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.874 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.52 66.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.95 -30.69 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.295 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.433 ' CZ ' ' HB3' ' A' ' 31' ' ' ASN . 7.3 t80 -75.81 -42.37 50.13 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.086 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -65.96 -48.01 72.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.944 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.5 p -67.79 -46.26 72.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.996 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.93 79.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.14 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.63 -24.47 58.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.403 ' OD2' ' CZ2' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -73.64 -50.82 19.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.055 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.48 -51.8 65.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.069 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.0 ptm85 -54.75 -40.73 69.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.208 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -47.88 35.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.872 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.62 -49.38 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.413 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -64.73 -29.44 70.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.171 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -28.91 69.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.129 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.9 m -80.11 -39.01 30.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.491 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.545 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.7 tpp -99.67 4.67 45.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.783 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.8 t30 77.27 91.79 0.07 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.971 0.415 . . . . 0.0 111.79 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.6 OUTLIER 40.34 48.97 2.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.468 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 2.5 tm? -119.96 118.07 29.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.695 0.284 . . . . 0.0 111.142 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.539 ' N ' ' CD1' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -132.79 160.48 36.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 110.979 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.0 t0 74.92 4.95 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.888 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.25 7.44 1.02 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.538 ' CD1' ' HA ' ' A' ' 60' ' ' TYR . 2.7 mp -63.34 110.61 3.8 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.43 -178.44 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.519 2.146 . . . . 0.0 112.245 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.82 -46.45 14.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.73 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -46.2 69.76 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.067 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.65 -55.12 25.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.428 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -59.86 -44.42 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.588 179.667 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -32.98 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.003 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -70.06 -50.22 43.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.417 HG23 ' CZ3' ' A' ' 68' ' ' TRP . 14.2 tt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.207 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.458 -0.035 0 CA-C-O 120.893 0.377 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -32.42 30.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.174 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.31 -35.89 40.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.03 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.1 -50.36 74.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.14 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.444 ' HB2' HG11 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -69.69 -52.03 29.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.825 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.2 tt -56.0 -40.59 73.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -42.92 84.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.5 mtt180 -76.28 -27.81 56.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -42.73 92.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -69.19 -22.23 63.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -56.06 -22.65 28.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.287 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.0 p -49.63 172.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.162 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.28 -35.22 8.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -150.01 159.7 44.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.88 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 mm -74.44 -39.34 48.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.596 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.9 -50.94 65.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.68 -29.02 65.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.661 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.471 ' O ' HG13 ' A' ' 28' ' ' ILE . 5.2 tt -74.66 -36.07 62.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -57.48 -32.47 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 0.0 110.195 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -64.5 -33.8 76.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.197 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.457 ' CG1' HD21 ' A' ' 24' ' ' LEU . 9.1 p -80.98 -26.8 10.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.204 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 24' ' ' LEU . 29.5 mt -59.01 -40.27 80.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.978 0.418 . . . . 0.0 110.313 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -74.73 -41.73 59.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.838 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -68.61 -47.68 66.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.243 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.44 ' HB2' ' CE2' ' A' ' 43' ' ' PHE . 2.3 m120 -66.08 -31.65 72.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.61 -48.1 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.139 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.16 -2.38 58.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.783 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 3.2 mt-10 -79.36 -77.86 0.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.759 0.314 . . . . 0.0 110.952 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.78 -157.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.204 0.526 . . . . 0.0 111.577 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.2 m -118.76 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.306 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -60.69 -25.4 66.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.536 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -73.67 -47.52 39.1 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.816 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.562 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 2.7 tp10 -78.86 -34.99 44.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.993 0.425 . . . . 0.0 110.15 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 ' N ' ' HG ' ' A' ' 35' ' ' LEU . 7.8 tt -57.99 -34.73 70.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.332 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -34.53 65.27 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.444 HG11 ' HB2' ' A' ' 11' ' ' TYR . 65.0 t -76.96 -33.29 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.337 178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 31' ' ' ASN . 8.9 t80 -76.1 -48.07 22.12 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.436 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.65 -48.3 81.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.5 p -67.96 -37.17 81.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.652 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.18 -40.16 46.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.789 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.28 -34.71 59.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.855 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.456 ' HB3' ' CH2' ' A' ' 68' ' ' TRP . 10.6 m-20 -72.0 -50.69 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.56 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.85 -45.14 74.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.129 0.49 . . . . 0.0 110.019 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -64.16 -47.86 78.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.681 0.753 . . . . 0.0 109.588 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.468 HD12 ' CZ3' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -60.89 -33.8 73.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.662 -1.153 . . . . 0.0 110.341 179.714 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.412 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -63.83 -51.32 65.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.099 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.419 ' O ' ' N ' ' A' ' 58' ' ' LYS . 5.0 pt-20 -57.34 -41.89 80.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.738 0.304 . . . . 0.0 110.767 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.8 mt -58.69 -31.78 68.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.921 0.391 . . . . 0.0 110.623 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.62 -33.19 27.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.951 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpp -95.99 15.93 19.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.496 -179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 65.87 68.86 0.46 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.045 0.45 . . . . 0.0 111.168 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 55.91 28.79 13.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.673 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -119.83 118.57 31.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.893 0.377 . . . . 0.0 111.485 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -128.57 161.23 30.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.666 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.499 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 13.8 t0 89.72 -12.41 0.35 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -131.24 20.48 4.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.734 0.302 . . . . 0.0 110.801 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.421 HG22 ' CD1' ' A' ' 68' ' ' TRP . 2.9 mp -62.21 110.69 3.53 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.034 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.23 166.02 2.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.47 2.114 . . . . 0.0 112.263 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.8 m -74.92 -40.26 60.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.931 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -43.74 98.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.929 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.5 t -65.71 -51.29 63.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.468 ' CZ3' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -57.67 -42.33 83.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -60.61 -30.57 69.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.731 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -75.96 -50.29 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 tt . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.183 -179.793 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.413 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.85 0.357 . . . . 0.0 110.722 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.418 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.9 OUTLIER -51.69 -37.54 51.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 -179.649 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.66 -29.23 40.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.413 ' HB2' ' N ' ' A' ' 7' ' ' THR . 3.3 m-20 -55.07 -50.79 68.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.654 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -76.75 -36.91 56.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.683 0.278 . . . . 0.0 111.065 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.14 -47.5 75.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.131 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.412 ' HE3' ' HB2' ' A' ' 13' ' ' MET . 34.7 mtm -76.92 -41.8 41.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -60.58 -37.06 80.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.807 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.28 -45.77 86.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.81 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -71.86 -22.61 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.964 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.62 -27.11 57.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.215 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 167.57 0.46 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -96.59 -41.4 8.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.119 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -131.43 160.81 34.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.408 HG22 HD13 ' A' ' 21' ' ' ILE . 44.6 mm -74.51 -41.15 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.294 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.2 -50.89 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.032 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -64.85 -44.52 89.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.009 0.433 . . . . 0.0 110.454 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.456 ' O ' HG13 ' A' ' 28' ' ' ILE . 1.5 tm? -58.38 -38.79 78.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -57.96 -38.11 75.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.087 0.47 . . . . 0.0 110.549 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -59.06 -38.84 80.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.635 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.45 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 6.3 p -72.97 -26.01 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 24' ' ' LEU . 22.7 mt -61.63 -38.17 79.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.952 0.406 . . . . 0.0 110.481 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -74.14 -36.41 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.738 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -36.11 60.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.854 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -78.55 -42.56 28.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.325 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -36.16 73.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.019 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -87.93 -19.87 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -68.42 -78.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.23 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.38 -158.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.214 0.53 . . . . 0.0 111.559 -179.687 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -178.11 3.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.325 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.35 -25.39 65.8 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.588 179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -74.16 -47.45 35.75 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.894 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.564 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -78.94 -33.92 44.94 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.005 0.431 . . . . 0.0 110.071 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.411 ' N ' ' HG ' ' A' ' 35' ' ' LEU . 7.5 tt -58.33 -32.97 68.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -30.57 61.8 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.418 HG13 ' HA ' ' A' ' 8' ' ' LYS . 89.0 t -76.84 -34.43 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.171 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.438 ' CZ ' ' HA ' ' A' ' 28' ' ' ILE . 13.1 t80 -75.98 -47.96 22.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.965 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.44 -42.61 87.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 39.8 m -60.01 -42.63 94.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.957 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.73 -30.64 61.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.309 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.07 -50.42 19.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.227 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.76 -48.05 80.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.01 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.5 m170 -56.05 -39.48 72.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.993 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -39.51 74.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.89 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.28 60.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.778 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.445 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -57.8 -51.18 70.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.245 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 24.6 pt-20 -61.94 -42.12 98.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.047 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -28.67 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.9 m -65.17 -42.92 93.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.636 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 57' ' ' ASN . 32.2 ttm -99.61 -30.76 11.94 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.612 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' MET . 4.5 m-20 156.94 -74.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.244 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -153.0 32.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.5 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.435 ' CG ' HG13 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -88.57 139.74 30.17 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.591 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.589 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -135.04 154.18 51.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.832 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.79 -62.09 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.423 ' N ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -56.96 -5.53 0.25 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.32 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.589 ' CD1' ' HA ' ' A' ' 60' ' ' TYR . 5.3 mp -60.94 110.26 2.82 Favored Pre-proline 0 C--N 1.33 -0.274 0 C-N-CA 121.167 -0.213 . . . . 0.0 110.712 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -66.65 -158.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.637 2.225 . . . . 0.0 112.067 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -98.2 -25.03 15.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.829 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.436 ' HA ' ' HG2' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -69.86 -46.15 66.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.969 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.86 -40.22 80.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.424 ' CD1' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -65.63 -39.1 91.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.964 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -66.27 -27.27 67.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.014 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.415 ' N ' ' HG3' ' A' ' 69' ' ' LYS . 12.3 t80 -66.31 -50.22 64.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 tt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.939 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.824 0.345 . . . . 0.0 110.709 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.407 ' HA ' ' CG1' ' A' ' 42' ' ' VAL . 0.1 OUTLIER -53.82 -31.71 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.228 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -36.09 55.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.476 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.83 -50.32 68.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.383 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.417 ' CG ' HG11 ' A' ' 42' ' ' VAL . 8.1 m-85 -74.84 -38.38 62.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.87 0.367 . . . . 0.0 110.91 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -55.5 -47.44 76.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -32.64 63.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 0.0 111.08 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.02 -23.91 59.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.923 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.94 -45.74 56.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.938 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -64.01 -17.17 63.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.499 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -54.05 -26.6 27.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.754 0.312 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.66 165.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.826 0.346 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -78.03 -40.68 38.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.2 t -149.93 165.74 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.0 mp -74.52 -29.93 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.39 -50.5 67.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.93 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -32.51 59.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.198 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.456 ' O ' HG12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -66.68 -36.18 81.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.444 179.622 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -57.15 -31.82 65.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.234 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -65.15 -34.95 79.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.114 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.451 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 8.6 p -79.84 -27.28 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.07 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 24' ' ' LEU . 39.0 mm -58.14 -39.91 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-O 121.113 0.482 . . . . 0.0 110.233 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -74.18 -43.18 58.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.563 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -64.17 -47.59 79.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.101 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 43' ' ' PHE . 0.7 OUTLIER -66.86 -31.66 72.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.031 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -58.55 -40.34 82.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.952 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -98.99 -0.06 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.507 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -78.91 -68.92 0.61 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.693 0.283 . . . . 0.0 111.216 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.547 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -72.67 -156.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.217 0.532 . . . . 0.0 111.611 -179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.6 t -118.71 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.098 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 p30 -59.65 -25.03 64.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -48.41 39.4 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.547 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.73 -29.92 40.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.962 0.41 . . . . 0.0 110.318 179.556 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.9 tt -57.41 -32.81 67.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.01 -35.59 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.417 HG11 ' CG ' ' A' ' 11' ' ' TYR . 57.9 t -76.78 -30.83 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.143 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 31' ' ' ASN . 8.9 t80 -75.83 -41.35 52.84 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.54 -48.18 80.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.5 p -59.95 -35.81 75.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.912 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.23 -29.71 54.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.242 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.23 -52.56 9.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.195 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.74 -44.72 90.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.995 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -58.78 -49.04 79.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.966 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -61.67 -44.71 96.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -30.71 69.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.412 ' CB ' ' CD1' ' A' ' 63' ' ' ILE . . . -62.54 -50.98 69.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.222 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.98 -30.68 71.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.856 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.55 -35.59 76.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.688 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -78.74 -36.3 43.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.92 20.87 10.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 78.48 -63.92 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.859 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -160.5 40.84 0.17 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.077 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -119.76 117.87 29.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 111.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.0 p90 -135.04 161.13 36.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.767 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.482 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 3.1 t0 89.08 -30.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.225 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -112.25 26.56 10.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.765 0.317 . . . . 0.0 110.893 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.416 HG21 ' CD1' ' A' ' 68' ' ' TRP . 1.9 mp -72.22 118.24 65.59 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.035 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 -167.61 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.416 2.077 . . . . 0.0 112.294 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -90.57 -26.63 19.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 92.0 p -70.17 -46.18 65.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 42.2 t -63.5 -54.96 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.441 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.53 -34.3 68.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.903 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -68.33 -30.32 69.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.87 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -73.95 -49.78 23.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.506 HG21 HD13 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.953 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 72.0 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.782 0.325 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -35.17 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.47 -34.64 41.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.05 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.97 -50.5 68.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.174 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -76.56 -43.76 37.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.428 . . . . 0.0 110.704 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.93 -47.08 78.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.228 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -31.21 69.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.3 mtt-85 -77.86 -30.35 50.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -45.65 81.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.04 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -64.6 -16.09 62.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.1 ttp85 -54.02 -28.5 38.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.777 0.322 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.65 179.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.872 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -99.22 -36.05 9.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.97 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -147.02 157.79 43.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.422 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 1.8 mp -73.77 -29.51 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.793 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.55 -49.9 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.732 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.4 -32.24 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.052 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.48 ' O ' HG12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -66.18 -35.69 81.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.401 179.571 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.16 -31.84 65.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.234 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -66.21 -37.87 86.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.223 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.465 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 9.1 p -75.39 -27.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 24' ' ' LEU . 35.7 mm -58.8 -42.41 85.43 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.999 0.428 . . . . 0.0 110.107 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -45.55 78.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -46.47 89.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.813 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 3.0 t-20 -75.22 -31.32 60.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -58.23 -30.41 66.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -106.26 -6.56 18.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.322 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -73.11 -69.04 0.44 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.645 0.26 . . . . 0.0 111.231 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -72.6 -156.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 111.527 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.61 -178.16 3.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.191 179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -25.03 64.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.86 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -72.84 -48.33 38.6 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.556 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.83 -29.94 40.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.956 0.408 . . . . 0.0 110.535 179.7 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.34 -34.59 70.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.022 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -36.51 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.3 t -76.97 -30.98 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.361 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 28' ' ' ILE . 27.7 t80 -75.85 -48.04 23.1 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.136 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -57.98 -47.51 82.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 89.6 p -59.99 -35.43 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.63 -42.11 82.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.17 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.27 -34.16 42.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.71 -50.77 69.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.25 -44.9 94.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 39.3 tpt85 -60.0 -40.78 90.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.656 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -39.74 63.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.791 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.27 -50.84 72.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.135 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.0 pt-20 -65.36 -27.04 68.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.298 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.32 -28.92 68.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.823 0.344 . . . . 0.0 110.926 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.3 m -82.82 -42.76 17.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.683 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.425 ' HB3' ' CB ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -98.94 5.87 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.388 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 71.8 103.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.941 0.401 . . . . 0.0 111.675 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.457 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 1.6 mmpt? 42.37 40.4 1.83 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.497 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.445 HD13 HD11 ' A' ' 63' ' ' ILE . 1.7 tm? -112.57 121.06 43.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.03 0.443 . . . . 0.0 110.96 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.45 157.64 40.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.773 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 65.18 -62.87 0.2 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -53.53 -11.64 0.37 Allowed 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.625 ' CD1' ' HA ' ' A' ' 60' ' ' TYR . 4.9 mp -60.86 116.88 20.64 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.603 0.24 . . . . 0.0 110.826 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.19 -167.34 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.551 2.167 . . . . 0.0 112.372 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 -39.87 22.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 95.0 p -59.32 -46.27 89.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.83 -43.7 85.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.955 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.434 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -62.77 -33.6 75.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -43.29 98.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.757 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -70.25 -39.7 74.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.811 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.0 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.015 179.905 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.846 0.355 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -29.92 71.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.085 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -29.38 42.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.1 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.79 -50.44 72.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.015 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.49 -44.53 34.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.2 tp -55.42 -36.87 66.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.048 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -45.86 67.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.064 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -67.7 -30.99 70.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -45.66 92.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.64 -13.96 61.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.391 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.62 -44.0 69.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.49 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 141.19 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.861 0.362 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -79.89 -36.66 36.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -105.02 147.22 28.06 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 120.838 0.352 . . . . 0.0 110.686 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 40.4 mm -74.43 -45.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.276 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -54.07 -51.0 65.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.949 0.404 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.71 -31.78 58.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.871 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.4 tm? -83.62 -38.19 21.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.798 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -33.56 68.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.055 0.455 . . . . 0.0 110.384 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -64.46 -35.01 79.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.333 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.462 ' CG1' HD23 ' A' ' 24' ' ' LEU . 9.8 p -79.02 -24.67 12.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.931 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 24' ' ' LEU . 25.8 mt -62.07 -38.93 82.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 121.003 0.43 . . . . 0.0 110.439 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -74.72 -43.4 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.147 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -70.41 -36.11 73.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.351 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 43' ' ' PHE . 26.2 t-20 -78.28 -41.61 33.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.624 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HE2' ' CD2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -58.65 -31.91 68.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 110.895 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.416 ' CD2' ' HE2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -92.23 -15.48 27.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -73.57 -71.68 0.3 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.288 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -62.08 -160.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.078 0.466 . . . . 0.0 111.792 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 t -119.16 -178.19 3.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -59.8 -25.23 64.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.541 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -73.71 -47.49 39.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.795 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.576 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -79.04 -35.45 42.6 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 120.986 0.422 . . . . 0.0 110.14 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.64 -31.16 69.26 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.996 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.03 -36.0 67.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.92 -30.76 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.924 178.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.463 ' CE2' ' HB3' ' A' ' 31' ' ' ASN . 5.9 t80 -74.27 -48.0 31.43 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.12 -47.99 83.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.137 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -37.02 79.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.988 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.58 -33.82 71.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.53 -37.2 71.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.151 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -45.43 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -58.23 -47.41 83.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.923 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -37.27 83.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.739 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -30.62 62.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.729 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.435 ' CB ' ' CD1' ' A' ' 63' ' ' ILE . . . -62.78 -51.17 68.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.489 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -30.91 70.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.81 -40.66 89.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.979 0.418 . . . . 0.0 110.483 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.7 m -82.55 -31.51 29.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.59 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.406 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 1.3 tpp -95.59 20.91 8.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.074 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 56' ' ' MET . 1.0 OUTLIER 75.24 -68.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.947 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -159.04 39.43 0.22 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.057 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.76 117.85 29.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 111.209 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.461 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -135.22 161.44 35.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.567 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.9 t70 87.05 -42.41 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.032 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 17.46 13.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.08 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.435 ' CD1' ' CB ' ' A' ' 52' ' ' ALA . 2.5 mp -61.84 110.58 3.33 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.884 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.14 -177.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.391 2.061 . . . . 0.0 112.127 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 95.2 p -89.81 -30.68 17.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.912 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 t -73.57 -42.81 61.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.22 -58.54 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.273 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.449 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.79 -34.14 69.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.803 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -40.24 89.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -75.61 -42.92 50.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.3 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.757 0.313 . . . . 0.0 110.774 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -64.65 -28.95 69.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.1 t -79.33 -35.49 40.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.061 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.55 -50.31 73.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.949 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -76.31 -44.82 35.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.706 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.4 tp -55.43 -40.56 71.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.922 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -39.13 69.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.006 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -31.55 62.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.57 -45.71 92.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.61 60.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.174 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -54.07 -28.81 41.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 m -58.95 159.92 6.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.32 -30.19 11.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.128 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.435 HG21 ' HB ' ' A' ' 23' ' ' THR . 13.0 t -126.34 146.78 49.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 111.134 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.5 mm -74.69 -32.91 30.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.134 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.98 -51.02 65.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.364 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.435 ' HB ' HG21 ' A' ' 20' ' ' THR . 0.9 OUTLIER -61.69 -41.77 98.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.893 0.377 . . . . 0.0 110.238 179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.609 ' HA ' HG22 ' A' ' 27' ' ' VAL . 1.4 mt -59.75 -36.9 77.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.26 70.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.656 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -78.64 -23.15 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.22 0.534 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.609 HG22 ' HA ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -93.23 -23.01 5.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.256 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 24' ' ' LEU . 1.8 mm -63.66 -48.19 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 8.3 mt-10 -75.25 -33.37 61.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.03 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -76.48 -47.69 22.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.861 0.362 . . . . 0.0 111.419 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 18.4 t-20 -70.5 -34.81 72.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.29 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -65.63 -36.63 84.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.39 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -1.12 57.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -86.62 -69.87 0.65 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.71 -157.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.112 0.482 . . . . 0.0 111.558 -179.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -118.87 -178.2 3.5 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.214 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -60.73 -25.36 66.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.528 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -47.66 39.05 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.794 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.564 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -78.89 -32.81 45.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.111 0.482 . . . . 0.0 110.06 179.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.8 tt -59.6 -34.82 73.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.056 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -35.39 66.35 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.7 t -76.87 -30.52 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.369 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.402 ' CG ' ' OD1' ' A' ' 31' ' ' ASN . 12.1 t80 -75.8 -48.0 23.46 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -60.13 -47.52 85.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.013 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -58.7 -46.61 86.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.022 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.6 -29.89 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.36 -39.93 37.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.305 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -50.7 69.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -61.2 -47.11 87.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.791 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 10.4 mmp_? -60.89 -39.77 90.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.661 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.18 -30.82 62.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.4 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -66.09 -51.19 60.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.346 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -61.96 -34.04 75.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.934 0.397 . . . . 0.0 110.591 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.93 -42.17 97.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 m -82.6 -27.0 31.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.571 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.441 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.3 tpp -99.07 13.32 33.26 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 63.77 75.89 0.37 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.938 0.399 . . . . 0.0 111.376 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.463 ' HA ' ' HE3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER 51.07 31.33 6.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.133 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 3.3 tm? -119.75 117.95 29.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.012 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.3 p90 -134.73 161.09 36.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.0 t0 91.12 -24.7 0.07 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -118.68 25.32 10.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.785 0.326 . . . . 0.0 110.713 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.43 HG21 ' CD1' ' A' ' 68' ' ' TRP . 2.3 mp -67.59 110.96 6.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.107 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.65 -156.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.368 2.045 . . . . 0.0 111.998 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.9 m -102.42 -46.19 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 m -57.68 -44.07 85.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.344 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.9 t -55.92 -60.45 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.408 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . 0.445 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.55 -30.73 65.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.628 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -72.06 -28.38 63.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.22 -50.29 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.428 HG21 ' CZ3' ' A' ' 68' ' ' TRP . 17.9 tt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.89 0.376 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -87.92 -31.58 19.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.968 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.499 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 1.0 OUTLIER -138.82 149.05 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.863 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 13.5 mttm -46.3 -57.86 7.66 Favored Pre-proline 0 N--CA 1.462 0.167 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.751 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 35.5 Cg_endo -63.97 -1.35 3.44 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.69 2.26 . . . . 0.0 112.626 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 mp 76.2 -167.85 0.07 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.859 0.361 . . . . 0.0 110.915 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.23 163.34 12.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.805 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -54.05 -27.19 30.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.037 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.2 t -78.19 -35.05 49.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.84 -50.41 73.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.841 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.415 ' HB2' ' CG1' ' A' ' 42' ' ' VAL . 1.3 m-85 -74.45 -43.73 54.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 110.406 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.06 -43.7 78.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.812 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.68 93.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.713 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 -24.39 58.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.085 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.72 -45.79 77.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.142 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -68.12 -17.95 64.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.243 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -56.26 -22.45 30.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.245 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.8 p -50.74 176.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -102.4 -34.05 9.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.988 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.4 t -153.03 164.6 37.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 43.7 mm -74.5 -41.58 49.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.425 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.23 -48.24 71.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.173 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.08 -40.88 37.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.22 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.442 ' O ' ' CG1' ' A' ' 27' ' ' VAL . 1.4 tm? -60.33 -38.04 82.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.14 -39.12 77.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.073 0.463 . . . . 0.0 110.528 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -59.06 -37.13 76.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.87 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.442 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 6.4 p -74.26 -26.44 20.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 24' ' ' LEU . 23.4 mt -60.42 -38.72 78.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.108 0.48 . . . . 0.0 110.234 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -70.53 -46.2 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.693 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -47.54 73.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -62.12 -34.11 75.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.884 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 -41.29 88.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -90.9 -21.79 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -72.62 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.132 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.569 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -67.3 -156.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.158 0.504 . . . . 0.0 111.421 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m -118.66 -178.21 3.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.242 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.91 -25.22 64.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -73.19 -48.06 38.39 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.569 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -79.58 -29.72 41.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.242 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 ' HB2' ' CD2' ' A' ' 35' ' ' LEU . 6.5 tt -61.35 -36.22 79.59 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.028 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.86 -37.41 68.73 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.415 ' CG1' ' HB2' ' A' ' 11' ' ' TYR . 12.5 t -77.04 -30.69 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.581 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -75.89 -37.98 58.27 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.829 0.347 . . . . 0.0 111.249 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.81 -48.11 48.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 96.8 p -62.11 -33.11 73.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.21 -37.72 57.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.173 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.94 -28.23 69.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.219 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -75.03 -46.27 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.052 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -42.25 71.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 109.84 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -48.11 73.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.329 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.426 HD13 ' CH2' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.93 -37.03 73.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.919 179.314 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.435 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -61.1 -51.1 70.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 60' ' ' TYR . 7.7 pt-20 -64.4 -29.6 70.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.624 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.7 mp -59.91 -35.29 74.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.917 0.389 . . . . 0.0 110.25 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 74.4 m -82.11 -34.81 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.475 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 3.4 tpp -96.52 20.08 11.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.993 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 1.4 m-20 77.45 -72.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.173 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER -151.23 34.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.666 0.269 . . . . 0.0 111.211 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -117.22 117.99 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 0.0 111.47 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.484 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.1 p90 -134.93 161.13 36.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.674 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 10.3 t0 88.1 -25.27 0.09 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.23 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.12 19.5 14.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.907 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.44 HG21 ' CD1' ' A' ' 68' ' ' TRP . 2.2 mp -63.39 119.42 53.11 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.786 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.88 -167.79 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.448 2.099 . . . . 0.0 112.352 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.0 p -88.72 -26.45 21.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.1 m -71.27 -46.36 61.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.098 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.64 -48.64 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.44 ' CD1' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -60.61 -44.42 96.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.733 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -56.51 -27.75 58.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.91 -50.16 15.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.264 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.3 tt -94.32 131.3 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.891 0.376 . . . . 0.0 111.42 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.867 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.786 0.327 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -123.41 -54.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.411 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 0.3 OUTLIER -133.47 141.14 47.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 2.6 mtpt -58.54 -57.7 24.6 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD2' ' CG ' ' A' ' 3' ' ' GLU . 91.0 Cg_endo -82.44 39.19 0.81 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.912 2.408 . . . . 0.0 112.857 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.414 HD13 ' CE1' ' A' ' 11' ' ' TYR . 3.6 mt 58.67 160.82 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.849 0.357 . . . . 0.0 111.265 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.11 179.52 4.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.948 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -30.0 68.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.066 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.43 -29.38 41.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.16 -50.33 70.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.084 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CE1' HD13 ' A' ' 6' ' ' LEU . 5.2 m-85 -73.83 -43.16 59.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.838 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' A' ' 49' ' ' HIS . 1.5 tp -55.35 -41.48 72.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.987 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.407 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.39 -42.49 59.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.078 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.04 -39.14 89.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.99 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.49 -44.7 93.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -74.85 -25.54 59.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.969 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -56.68 -22.46 35.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.288 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.4 173.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.775 0.322 . . . . 0.0 111.145 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -101.38 -38.08 8.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.183 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.401 HG23 ' HB ' ' A' ' 23' ' ' THR . 13.3 t -140.85 159.96 41.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.1 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.3 mm -74.49 -37.76 44.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.345 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -53.98 -50.94 65.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.401 ' HB ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -72.96 -30.37 63.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.905 0.383 . . . . 0.0 110.514 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.457 ' O ' ' CG1' ' A' ' 27' ' ' VAL . 1.5 tm? -70.26 -39.13 75.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.663 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -58.03 -39.31 78.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.102 0.477 . . . . 0.0 110.533 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -35.03 71.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.728 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.457 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 5.8 p -77.47 -26.41 15.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.093 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.428 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 35.9 mt -59.18 -39.01 77.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.977 0.417 . . . . 0.0 110.42 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.54 -43.53 55.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.821 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 mmtp -65.69 -47.6 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.454 ' CB ' ' CE2' ' A' ' 43' ' ' PHE . 2.6 m120 -68.38 -31.7 71.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.084 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -36.16 78.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.084 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.35 -22.01 16.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.407 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER -57.55 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.227 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.546 ' C ' ' CD2' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.93 -156.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.229 0.538 . . . . 0.0 111.553 -179.75 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.8 m -118.67 -178.24 3.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.128 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -59.55 -25.01 64.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.88 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -73.15 -48.32 36.51 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -79.7 -30.31 40.98 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.412 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.99 -35.03 70.63 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.834 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -30.88 62.14 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 47.0 t -76.78 -33.4 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.23 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 31' ' ' ASN . 9.9 t80 -75.87 -43.25 46.46 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.955 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -42.29 98.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.831 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.5 p -58.38 -46.0 87.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.813 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.69 68.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.998 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.09 -47.19 85.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.58 -48.67 76.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.412 ' CD2' HD13 ' A' ' 12' ' ' LEU . 28.9 t60 -60.02 -45.38 92.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -64.75 -48.13 75.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.661 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -30.67 69.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.696 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.447 ' HB2' HG12 ' A' ' 63' ' ' ILE . . . -61.46 -51.58 68.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.315 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.519 ' N ' ' HB2' ' A' ' 59' ' ' LEU . 2.1 tm-20 -64.4 -26.88 68.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.66 -179.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.0 mt -78.36 -36.58 45.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 m -82.97 -43.4 16.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -178.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.415 ' CB ' HD23 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.61 3.49 16.71 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.431 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.467 ' HA ' ' O ' ' A' ' 53' ' ' GLU . 2.1 t30 63.88 126.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.815 0.34 . . . . 0.0 110.581 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.434 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 0.4 OUTLIER 49.47 86.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.02 0.438 . . . . 0.0 110.805 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.519 ' HB2' ' N ' ' A' ' 53' ' ' GLU . 4.1 mm? -119.79 148.62 43.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.666 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.546 ' O ' ' CD1' ' A' ' 63' ' ' ILE . 31.1 m-85 -83.07 161.08 21.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.913 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -61.56 -17.07 53.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.446 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.71 78.43 1.85 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.806 0.336 . . . . 0.0 111.572 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.546 ' CD1' ' O ' ' A' ' 60' ' ' TYR . 1.3 mp -68.41 136.05 90.96 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.651 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.27 -157.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.473 2.115 . . . . 0.0 112.208 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 t -99.44 -34.11 10.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.2 m -59.99 -46.18 90.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.7 t -61.37 -45.55 98.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.042 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.554 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -66.8 -23.63 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.148 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -28.59 62.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.034 179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -76.39 -50.32 14.5 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.805 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.506 HD11 HG21 ' A' ' 71' ' ' ILE . 7.4 pt -42.58 125.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.762 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.857 -179.974 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.844 0.354 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 m -103.3 99.47 9.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.874 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -136.29 -176.6 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.903 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.436 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 0.7 OUTLIER -52.79 -61.61 4.48 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.436 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 25.4 Cg_endo -62.1 -166.8 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.401 2.067 . . . . 0.0 112.131 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.414 ' N ' ' CD2' ' A' ' 6' ' ' LEU . 2.8 mm? -117.18 119.58 35.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -86.54 179.51 6.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.968 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -34.5 71.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.41 -30.04 42.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.055 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -61.92 -50.35 72.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.187 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -68.18 -51.95 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.878 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.37 -45.04 76.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.047 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -45.32 71.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.919 0.39 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -29.52 70.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.905 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -45.96 89.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.053 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -67.86 -16.87 64.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.274 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -53.95 -24.66 17.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.43 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.74 168.76 4.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.876 0.369 . . . . 0.0 111.105 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -41.76 6.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.951 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.431 HG21 ' HB ' ' A' ' 23' ' ' THR . 12.8 t -129.16 150.72 50.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.783 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' NH2' ' A' ' 50' ' ' ARG . 39.0 mm -67.56 -39.61 82.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.767 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.99 -51.03 65.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.665 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.431 ' HB ' HG21 ' A' ' 20' ' ' THR . 1.0 OUTLIER -74.61 -29.42 61.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.436 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.402 HD21 HG11 ' A' ' 27' ' ' VAL . 3.0 tt -69.76 -38.66 76.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.587 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.48 -30.15 64.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.041 0.448 . . . . 0.0 110.456 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -60.26 -33.09 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.402 HG11 HD21 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -77.06 -31.36 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.079 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.402 ' CD1' ' CD2' ' A' ' 24' ' ' LEU . 1.7 mp -59.15 -33.31 50.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 110.194 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.78 -49.0 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.949 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -33.08 72.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -74.3 -42.46 59.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.26 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HG3' ' N ' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -59.85 -30.16 68.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.892 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.437 ' N ' ' HG3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -98.72 -5.74 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.409 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -70.16 0.52 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.797 0.332 . . . . 0.0 111.232 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.26 -160.42 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.285 0.564 . . . . 0.0 111.97 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -119.17 -178.03 3.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.164 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.65 -25.29 66.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.378 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -72.36 -47.49 49.17 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.733 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 1.9 tp10 -78.79 -29.67 45.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.928 0.394 . . . . 0.0 110.201 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.17 -31.21 65.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.715 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.02 -32.4 63.96 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 72.4 t -76.84 -32.79 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.042 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -75.94 -42.63 48.13 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.868 0.366 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.48 -48.13 68.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.1 t -58.87 -46.52 87.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.853 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.02 -28.57 64.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.149 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.31 -66.34 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.334 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -54.94 -43.66 73.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.183 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -51.6 67.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.837 0.351 . . . . 0.0 110.459 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.413 ' NH2' ' CD1' ' A' ' 21' ' ' ILE . 0.7 OUTLIER -61.24 -40.75 95.21 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.119 0.485 . . . . 0.0 109.955 179.161 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.71 -34.8 78.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.159 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.419 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -65.34 -51.04 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.15 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.7 pt-20 -56.93 -41.89 79.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.859 0.361 . . . . 0.0 110.465 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.12 -29.04 65.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.205 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.7 m -82.34 -36.01 27.29 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.092 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.458 ' HB2' ' HB3' ' A' ' 59' ' ' LEU . 11.4 mmm -93.12 17.96 10.09 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 m120 64.38 62.71 0.8 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.962 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? 64.71 27.23 13.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.977 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 56' ' ' MET . 1.0 OUTLIER -119.96 121.51 39.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.94 0.4 . . . . 0.0 111.372 179.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.479 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 4.4 p90 -126.35 161.47 27.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.563 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 1.1 t70 87.7 -7.75 0.59 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.027 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -128.6 13.62 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.704 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.433 HG22 ' CD1' ' A' ' 68' ' ' TRP . 1.8 mp -65.2 118.2 47.44 Favored Pre-proline 0 C--N 1.333 -0.127 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.903 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.25 -168.17 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.407 2.071 . . . . 0.0 112.22 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -92.34 -28.61 16.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.6 m -68.39 -46.2 70.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 23.3 t -69.19 -49.43 61.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.105 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.455 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.65 -40.58 79.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -63.03 -30.89 71.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.779 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -70.9 -50.18 37.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.4 tt -91.66 125.16 44.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.064 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.784 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 mtt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.655 0.264 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.4 p -66.55 109.99 3.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.988 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -166.25 -175.16 3.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.796 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' CB ' ' CD ' ' A' ' 5' ' ' PRO . 18.3 mtmt -52.93 -62.38 3.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.819 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' A' ' 4' ' ' LYS . 98.1 Cg_endo -78.56 57.42 6.31 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.543 2.162 . . . . 0.0 112.176 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -105.08 -79.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.988 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.2 p -147.72 170.74 16.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.832 0.348 . . . . 0.0 110.843 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -59.14 -38.88 80.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.742 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -42.79 85.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.003 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.1 -50.37 69.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.007 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.6 -44.26 35.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.971 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -55.38 -47.32 76.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.293 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -69.72 -31.17 69.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.777 0.323 . . . . 0.0 110.935 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -77.9 -29.69 50.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.023 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.28 -45.81 79.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.077 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -18.03 63.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -23.65 19.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.26 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -173.1 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -102.29 -39.93 6.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.6 t -139.2 150.64 45.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.101 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.3 mp -74.63 -32.49 29.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.864 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -55.87 -50.96 69.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.425 ' CG2' ' N ' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -63.47 -45.46 90.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.494 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.474 ' O ' HG13 ' A' ' 27' ' ' VAL . 1.9 mt -56.04 -31.49 63.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -39.85 79.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.091 0.472 . . . . 0.0 109.823 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -48.18 77.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.23 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 24' ' ' LEU . 3.8 p -71.75 -23.85 22.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 tp -59.16 -38.48 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.337 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -43.51 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.691 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -64.64 -47.45 78.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.433 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 1.1 t-20 -59.01 -34.61 72.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.903 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -58.63 -47.22 85.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.656 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -88.54 -7.09 57.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.123 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -74.55 -67.62 0.61 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.128 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.559 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.23 -155.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.193 0.521 . . . . 0.0 111.388 -179.804 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.9 t -118.56 -178.25 3.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.168 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.0 -25.08 64.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.837 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -72.76 -48.26 39.88 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.559 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -79.79 -29.83 40.47 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.513 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.2 tt -58.93 -36.72 75.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.874 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.52 66.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.95 -30.69 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.295 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.433 ' CZ ' ' HB3' ' A' ' 31' ' ' ASN . 7.3 t80 -75.81 -42.37 50.13 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.086 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -65.96 -48.01 72.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.944 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.5 p -67.79 -46.26 72.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.996 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.93 79.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.14 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.63 -24.47 58.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.403 ' OD2' ' CZ2' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -73.64 -50.82 19.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.055 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.48 -51.8 65.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.069 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.0 ptm85 -54.75 -40.73 69.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.208 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -47.88 35.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.872 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.62 -49.38 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.413 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -64.73 -29.44 70.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.171 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.8 -28.91 69.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.129 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.9 m -80.11 -39.01 30.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.491 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.545 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.7 tpp -99.67 4.67 45.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.783 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.8 t30 77.27 91.79 0.07 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.971 0.415 . . . . 0.0 111.79 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.6 OUTLIER 40.34 48.97 2.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.468 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 2.5 tm? -119.96 118.07 29.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.695 0.284 . . . . 0.0 111.142 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -132.79 160.48 36.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 110.979 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.0 t0 74.92 4.95 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.888 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.25 7.44 1.02 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.538 ' CD1' ' HA ' ' A' ' 60' ' ' TYR . 2.7 mp -63.34 110.61 3.8 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.43 -178.44 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.519 2.146 . . . . 0.0 112.245 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.82 -46.45 14.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.73 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -46.2 69.76 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.067 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.65 -55.12 25.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.428 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -59.86 -44.42 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.588 179.667 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -32.98 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.003 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -70.06 -50.22 43.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.417 HG23 ' CZ3' ' A' ' 68' ' ' TRP . 14.2 tt -93.3 119.04 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.207 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -67.39 81.08 0.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -178.76 -98.93 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.553 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 5' ' ' PRO . 0.1 OUTLIER 52.85 174.98 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.179 0 CA-C-O 120.607 0.241 . . . . 0.0 110.926 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 4' ' ' LYS . 24.6 Cg_exo -63.19 72.62 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.511 2.141 . . . . 0.0 112.183 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.411 ' N ' ' O ' ' A' ' 4' ' ' LYS . 3.6 mm? 61.45 83.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.14 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p -84.63 179.63 7.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.872 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -32.42 30.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.174 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.31 -35.89 40.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.03 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.1 -50.36 74.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.14 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.444 ' HB2' HG11 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -69.69 -52.03 29.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.825 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.2 tt -56.0 -40.59 73.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -42.92 84.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.5 mtt180 -76.28 -27.81 56.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -42.73 92.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -69.19 -22.23 63.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -56.06 -22.65 28.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.287 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.0 p -49.63 172.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.162 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.28 -35.22 8.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.9 t -150.01 159.7 44.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.88 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 41.1 mm -74.44 -39.34 48.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.596 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.9 -50.94 65.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.68 -29.02 65.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.661 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' O ' HG13 ' A' ' 28' ' ' ILE . 5.2 tt -74.66 -36.07 62.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -57.48 -32.47 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 0.0 110.195 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -64.5 -33.8 76.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.197 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.457 ' CG1' HD21 ' A' ' 24' ' ' LEU . 9.1 p -80.98 -26.8 10.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.204 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 24' ' ' LEU . 29.5 mt -59.01 -40.27 80.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.978 0.418 . . . . 0.0 110.313 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -74.73 -41.73 59.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.838 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -68.61 -47.68 66.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.243 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.44 ' HB2' ' CE2' ' A' ' 43' ' ' PHE . 2.3 m120 -66.08 -31.65 72.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.61 -48.1 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.139 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.16 -2.38 58.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.783 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 3.2 mt-10 -79.36 -77.86 0.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.759 0.314 . . . . 0.0 110.952 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.78 -157.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.204 0.526 . . . . 0.0 111.577 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.2 m -118.76 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.306 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -60.69 -25.4 66.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.536 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -73.67 -47.52 39.1 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.816 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.562 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 2.7 tp10 -78.86 -34.99 44.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.993 0.425 . . . . 0.0 110.15 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 ' N ' ' HG ' ' A' ' 35' ' ' LEU . 7.8 tt -57.99 -34.73 70.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.332 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -34.53 65.27 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.444 HG11 ' HB2' ' A' ' 11' ' ' TYR . 65.0 t -76.96 -33.29 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.337 178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 31' ' ' ASN . 8.9 t80 -76.1 -48.07 22.12 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.436 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.65 -48.3 81.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.5 p -67.96 -37.17 81.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.652 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.18 -40.16 46.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.789 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.28 -34.71 59.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.855 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.456 ' HB3' ' CH2' ' A' ' 68' ' ' TRP . 10.6 m-20 -72.0 -50.69 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.56 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.85 -45.14 74.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.129 0.49 . . . . 0.0 110.019 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -64.16 -47.86 78.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.681 0.753 . . . . 0.0 109.588 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.468 HD12 ' CZ3' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -60.89 -33.8 73.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.662 -1.153 . . . . 0.0 110.341 179.714 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.412 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -63.83 -51.32 65.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.099 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.419 ' O ' ' N ' ' A' ' 58' ' ' LYS . 5.0 pt-20 -57.34 -41.89 80.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.738 0.304 . . . . 0.0 110.767 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.8 mt -58.69 -31.78 68.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.921 0.391 . . . . 0.0 110.623 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.62 -33.19 27.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.951 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpp -95.99 15.93 19.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.496 -179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 65.87 68.86 0.46 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.045 0.45 . . . . 0.0 111.168 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 55.91 28.79 13.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.673 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -119.83 118.57 31.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.893 0.377 . . . . 0.0 111.485 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -128.57 161.23 30.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.666 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.499 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 13.8 t0 89.72 -12.41 0.35 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -131.24 20.48 4.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.734 0.302 . . . . 0.0 110.801 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.421 HG22 ' CD1' ' A' ' 68' ' ' TRP . 2.9 mp -62.21 110.69 3.53 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.034 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.23 166.02 2.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.47 2.114 . . . . 0.0 112.263 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.8 m -74.92 -40.26 60.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.931 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -43.74 98.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.929 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.5 t -65.71 -51.29 63.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.468 ' CZ3' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -57.67 -42.33 83.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -60.61 -30.57 69.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.731 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -75.96 -50.29 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.5 tt -92.59 124.38 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.183 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.883 -179.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.86 0.362 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.92 15.99 5.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 64.39 -102.88 0.1 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.616 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 2.7 mttm 54.89 173.25 0.04 OUTLIER Pre-proline 0 CA--C 1.529 0.142 0 O-C-N 122.354 -0.216 . . . . 0.0 110.519 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 4' ' ' LYS . 23.1 Cg_endo -61.89 75.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.083 1.855 . . . . 0.0 111.835 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' A' ' 4' ' ' LYS . 2.6 mm? 63.89 88.92 0.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.029 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.413 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -83.84 178.79 7.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.418 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.9 OUTLIER -51.69 -37.54 51.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 -179.649 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.66 -29.23 40.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.413 ' HB2' ' N ' ' A' ' 7' ' ' THR . 3.3 m-20 -55.07 -50.79 68.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.654 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -76.75 -36.91 56.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.683 0.278 . . . . 0.0 111.065 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.7 mt -55.14 -47.5 75.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.131 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.412 ' HE3' ' HB2' ' A' ' 13' ' ' MET . 34.7 mtm -76.92 -41.8 41.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -60.58 -37.06 80.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.807 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 tt -64.28 -45.77 86.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.81 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -71.86 -22.61 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.964 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.62 -27.11 57.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.215 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 167.57 0.46 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -96.59 -41.4 8.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.119 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.9 t -131.43 160.81 34.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.408 HG22 HD13 ' A' ' 21' ' ' ILE . 44.6 mm -74.51 -41.15 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.294 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.2 -50.89 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.032 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.407 ' CG2' ' N ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -64.85 -44.52 89.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.009 0.433 . . . . 0.0 110.454 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.456 ' O ' HG13 ' A' ' 28' ' ' ILE . 1.5 tm? -58.38 -38.79 78.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -57.96 -38.11 75.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.087 0.47 . . . . 0.0 110.549 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -59.06 -38.84 80.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.635 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.45 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 6.3 p -72.97 -26.01 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 24' ' ' LEU . 22.7 mt -61.63 -38.17 79.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.952 0.406 . . . . 0.0 110.481 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -74.14 -36.41 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.738 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -36.11 60.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.854 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -78.55 -42.56 28.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.325 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -36.16 73.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.019 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -87.93 -19.87 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -68.42 -78.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.23 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.38 -158.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.214 0.53 . . . . 0.0 111.559 -179.687 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -178.11 3.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.325 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.35 -25.39 65.8 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.588 179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -74.16 -47.45 35.75 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.894 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.564 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -78.94 -33.92 44.94 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.005 0.431 . . . . 0.0 110.071 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.411 ' N ' ' HG ' ' A' ' 35' ' ' LEU . 7.5 tt -58.33 -32.97 68.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -30.57 61.8 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.418 HG13 ' HA ' ' A' ' 8' ' ' LYS . 89.0 t -76.84 -34.43 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.171 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.438 ' CZ ' ' HA ' ' A' ' 28' ' ' ILE . 13.1 t80 -75.98 -47.96 22.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.965 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.44 -42.61 87.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 39.8 m -60.01 -42.63 94.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.957 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.73 -30.64 61.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.309 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.07 -50.42 19.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.227 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.76 -48.05 80.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.01 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.5 m170 -56.05 -39.48 72.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.993 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -39.51 74.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.89 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.28 60.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.778 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.445 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -57.8 -51.18 70.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.245 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 24.6 pt-20 -61.94 -42.12 98.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.047 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.95 -28.67 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.9 m -65.17 -42.92 93.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.636 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 57' ' ' ASN . 32.2 ttm -99.61 -30.76 11.94 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.612 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' MET . 4.5 m-20 156.94 -74.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.244 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -153.0 32.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.5 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.435 ' CG ' HG13 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -88.57 139.74 30.17 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.591 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.589 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -135.04 154.18 51.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.832 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.79 -62.09 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.423 ' N ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -56.96 -5.53 0.25 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.32 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.589 ' CD1' ' HA ' ' A' ' 60' ' ' TYR . 5.3 mp -60.94 110.26 2.82 Favored Pre-proline 0 C--N 1.33 -0.274 0 C-N-CA 121.167 -0.213 . . . . 0.0 110.712 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -66.65 -158.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.637 2.225 . . . . 0.0 112.067 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -98.2 -25.03 15.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.829 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.436 ' HA ' ' HG2' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -69.86 -46.15 66.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.969 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.86 -40.22 80.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.424 ' CD1' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -65.63 -39.1 91.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.964 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -66.27 -27.27 67.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.014 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.415 ' N ' ' HG3' ' A' ' 69' ' ' LYS . 12.3 t80 -66.31 -50.22 64.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 tt -87.09 144.24 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.865 179.959 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 tpt . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.92 0.39 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.7 m -150.05 -73.44 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -147.17 142.25 27.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.81 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -58.31 17.83 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.117 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -77.6 44.8 1.6 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.731 2.288 . . . . 0.0 113.239 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.4 ' CD2' ' N ' ' A' ' 6' ' ' LEU . 2.4 mm? 59.63 148.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.081 0.467 . . . . 0.0 111.626 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.63 179.5 4.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.407 ' HA ' ' CG1' ' A' ' 42' ' ' VAL . 0.1 OUTLIER -53.82 -31.71 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.228 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -36.09 55.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.476 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.83 -50.32 68.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.383 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.417 ' CG ' HG11 ' A' ' 42' ' ' VAL . 8.1 m-85 -74.84 -38.38 62.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.87 0.367 . . . . 0.0 110.91 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -55.5 -47.44 76.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -32.64 63.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 0.0 111.08 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -74.02 -23.91 59.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.923 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.94 -45.74 56.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.938 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -64.01 -17.17 63.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.499 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -54.05 -26.6 27.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.754 0.312 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.66 165.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.826 0.346 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -78.03 -40.68 38.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.2 t -149.93 165.74 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.0 mp -74.52 -29.93 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.39 -50.5 67.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.93 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -32.51 59.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.198 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.456 ' O ' HG12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -66.68 -36.18 81.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.444 179.622 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -57.15 -31.82 65.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.234 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -65.15 -34.95 79.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.114 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.451 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 8.6 p -79.84 -27.28 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.07 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 24' ' ' LEU . 39.0 mm -58.14 -39.91 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-O 121.113 0.482 . . . . 0.0 110.233 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -74.18 -43.18 58.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.563 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -64.17 -47.59 79.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.101 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 43' ' ' PHE . 0.7 OUTLIER -66.86 -31.66 72.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.031 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -58.55 -40.34 82.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.952 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -98.99 -0.06 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.507 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -78.91 -68.92 0.61 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.693 0.283 . . . . 0.0 111.216 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.547 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -72.67 -156.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.217 0.532 . . . . 0.0 111.611 -179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.6 t -118.71 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.098 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 p30 -59.65 -25.03 64.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -48.41 39.4 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.547 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.73 -29.92 40.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.962 0.41 . . . . 0.0 110.318 179.556 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.9 tt -57.41 -32.81 67.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.01 -35.59 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.417 HG11 ' CG ' ' A' ' 11' ' ' TYR . 57.9 t -76.78 -30.83 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.143 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 31' ' ' ASN . 8.9 t80 -75.83 -41.35 52.84 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.54 -48.18 80.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.5 p -59.95 -35.81 75.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.912 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.23 -29.71 54.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.242 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.23 -52.56 9.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.195 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.74 -44.72 90.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.995 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -58.78 -49.04 79.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.966 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -61.67 -44.71 96.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -30.71 69.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.412 ' CB ' ' CD1' ' A' ' 63' ' ' ILE . . . -62.54 -50.98 69.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.222 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.98 -30.68 71.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.856 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.55 -35.59 76.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.688 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -78.74 -36.3 43.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.92 20.87 10.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 78.48 -63.92 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.859 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -160.5 40.84 0.17 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.077 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -119.76 117.87 29.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 111.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.0 p90 -135.04 161.13 36.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.767 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.482 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 3.1 t0 89.08 -30.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.225 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -112.25 26.56 10.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.765 0.317 . . . . 0.0 110.893 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.416 HG21 ' CD1' ' A' ' 68' ' ' TRP . 1.9 mp -72.22 118.24 65.59 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.035 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.68 -167.61 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.416 2.077 . . . . 0.0 112.294 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -90.57 -26.63 19.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 92.0 p -70.17 -46.18 65.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 42.2 t -63.5 -54.96 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.441 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.53 -34.3 68.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.903 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -68.33 -30.32 69.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.87 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -73.95 -49.78 23.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.506 HG21 HD13 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -91.23 118.86 37.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.953 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.911 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 mtm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.8 t -115.08 119.59 36.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.933 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -77.72 179.75 6.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 0.6 OUTLIER -59.66 -52.45 73.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.851 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.421 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 38.9 Cg_exo -60.53 -159.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.538 2.159 . . . . 0.0 112.028 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -97.14 115.3 27.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 72.0 p -83.99 177.76 8.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.046 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -35.17 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.47 -34.64 41.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.05 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.97 -50.5 68.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.174 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -76.56 -43.76 37.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.428 . . . . 0.0 110.704 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.93 -47.08 78.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.228 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -31.21 69.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.3 mtt-85 -77.86 -30.35 50.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -45.65 81.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.04 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -64.6 -16.09 62.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.1 ttp85 -54.02 -28.5 38.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.777 0.322 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.65 179.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.872 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -99.22 -36.05 9.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.97 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.6 t -147.02 157.79 43.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.422 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 1.8 mp -73.77 -29.51 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.793 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.55 -49.9 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.732 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.4 -32.24 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.052 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.48 ' O ' HG12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -66.18 -35.69 81.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.401 179.571 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.16 -31.84 65.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.234 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -66.21 -37.87 86.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.223 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.465 ' CG1' ' O ' ' A' ' 24' ' ' LEU . 9.1 p -75.39 -27.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 24' ' ' LEU . 35.7 mm -58.8 -42.41 85.43 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.999 0.428 . . . . 0.0 110.107 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -45.55 78.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -46.47 89.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.813 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 3.0 t-20 -75.22 -31.32 60.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -58.23 -30.41 66.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -106.26 -6.56 18.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.322 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -73.11 -69.04 0.44 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.645 0.26 . . . . 0.0 111.231 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -72.6 -156.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 111.527 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.61 -178.16 3.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.191 179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -25.03 64.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.86 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -72.84 -48.33 38.6 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.556 ' HB2' ' CD1' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.83 -29.94 40.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.956 0.408 . . . . 0.0 110.535 179.7 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.9 tt -58.34 -34.59 70.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.022 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -36.51 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 43.3 t -76.97 -30.98 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.361 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 28' ' ' ILE . 27.7 t80 -75.85 -48.04 23.1 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.136 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -57.98 -47.51 82.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 89.6 p -59.99 -35.43 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.63 -42.11 82.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.17 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.27 -34.16 42.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.71 -50.77 69.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.25 -44.9 94.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 39.3 tpt85 -60.0 -40.78 90.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.656 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.94 -39.74 63.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.791 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.27 -50.84 72.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.135 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.414 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 2.0 pt-20 -65.36 -27.04 68.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.298 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.32 -28.92 68.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.823 0.344 . . . . 0.0 110.926 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.3 m -82.82 -42.76 17.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.683 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.425 ' HB3' ' CB ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -98.94 5.87 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.388 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 71.8 103.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.941 0.401 . . . . 0.0 111.675 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.457 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 1.6 mmpt? 42.37 40.4 1.83 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.497 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.445 HD13 HD11 ' A' ' 63' ' ' ILE . 1.7 tm? -112.57 121.06 43.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.03 0.443 . . . . 0.0 110.96 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.45 157.64 40.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.773 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 65.18 -62.87 0.2 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -53.53 -11.64 0.37 Allowed 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.625 ' CD1' ' HA ' ' A' ' 60' ' ' TYR . 4.9 mp -60.86 116.88 20.64 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.603 0.24 . . . . 0.0 110.826 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.19 -167.34 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.551 2.167 . . . . 0.0 112.372 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 -39.87 22.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 95.0 p -59.32 -46.27 89.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.83 -43.7 85.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.955 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.434 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -62.77 -33.6 75.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -43.29 98.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.757 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -70.25 -39.7 74.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.811 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.0 mt -72.02 108.38 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.015 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.833 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.822 0.344 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -164.7 -72.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -98.95 157.43 16.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 8.8 mttp -65.66 -62.15 4.84 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.111 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 18.6 Cg_endo -57.98 -77.88 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.601 2.201 . . . . 0.0 112.584 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.18 137.94 54.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.873 0.368 . . . . 0.0 111.069 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 p -93.64 177.61 5.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -29.92 71.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.085 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -29.38 42.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.1 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.79 -50.44 72.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.015 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.49 -44.53 34.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.2 tp -55.42 -36.87 66.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.048 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -45.86 67.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.064 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -67.7 -30.99 70.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -45.66 92.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.64 -13.96 61.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.391 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.62 -44.0 69.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.49 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 141.19 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.861 0.362 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -79.89 -36.66 36.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -105.02 147.22 28.06 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 120.838 0.352 . . . . 0.0 110.686 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 40.4 mm -74.43 -45.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.276 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -54.07 -51.0 65.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.949 0.404 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.71 -31.78 58.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.871 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 28' ' ' ILE . 3.4 tm? -83.62 -38.19 21.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.798 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -33.56 68.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.055 0.455 . . . . 0.0 110.384 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -64.46 -35.01 79.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.333 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.462 ' CG1' HD23 ' A' ' 24' ' ' LEU . 9.8 p -79.02 -24.67 12.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.931 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 24' ' ' LEU . 25.8 mt -62.07 -38.93 82.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 121.003 0.43 . . . . 0.0 110.439 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -74.72 -43.4 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.147 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -70.41 -36.11 73.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.351 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 43' ' ' PHE . 26.2 t-20 -78.28 -41.61 33.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.624 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' HE2' ' CD2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -58.65 -31.91 68.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 110.895 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.416 ' CD2' ' HE2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -92.23 -15.48 27.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -73.57 -71.68 0.3 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.288 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.576 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -62.08 -160.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.078 0.466 . . . . 0.0 111.792 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 t -119.16 -178.19 3.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -59.8 -25.23 64.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.541 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -73.71 -47.49 39.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.795 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.576 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -79.04 -35.45 42.6 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 120.986 0.422 . . . . 0.0 110.14 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.6 tt -59.64 -31.16 69.26 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.996 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.03 -36.0 67.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 91.7 t -76.92 -30.76 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.924 178.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.463 ' CE2' ' HB3' ' A' ' 31' ' ' ASN . 5.9 t80 -74.27 -48.0 31.43 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.12 -47.99 83.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.137 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -37.02 79.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.988 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.58 -33.82 71.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.53 -37.2 71.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.151 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -45.43 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -58.23 -47.41 83.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.923 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -37.27 83.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.739 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -30.62 62.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.729 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.435 ' CB ' ' CD1' ' A' ' 63' ' ' ILE . . . -62.78 -51.17 68.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.489 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -30.91 70.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.81 -40.66 89.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.979 0.418 . . . . 0.0 110.483 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.7 m -82.55 -31.51 29.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.59 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.406 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 1.3 tpp -95.59 20.91 8.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.074 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 56' ' ' MET . 1.0 OUTLIER 75.24 -68.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.947 -179.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -159.04 39.43 0.22 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.057 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -119.76 117.85 29.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 111.209 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.461 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -135.22 161.44 35.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.567 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.9 t70 87.05 -42.41 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.032 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 17.46 13.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.08 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.435 ' CD1' ' CB ' ' A' ' 52' ' ' ALA . 2.5 mp -61.84 110.58 3.33 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.884 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.14 -177.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.391 2.061 . . . . 0.0 112.127 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 95.2 p -89.81 -30.68 17.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.912 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 t -73.57 -42.81 61.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.22 -58.54 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.273 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.449 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.79 -34.14 69.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.803 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -40.24 89.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -75.61 -42.92 50.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.3 mt -66.85 132.1 32.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mtt-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.159 -0.924 . . . . 0.0 110.907 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.783 0.325 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -117.74 -39.27 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.026 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.402 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 0.6 OUTLIER -112.62 146.8 37.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.4 ' CB ' ' CD ' ' A' ' 5' ' ' PRO . 1.4 tttp -57.6 -60.52 9.6 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.878 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.402 ' HD2' ' CG ' ' A' ' 3' ' ' GLU . 61.2 Cg_endo -73.1 57.4 3.3 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.517 2.145 . . . . 0.0 112.41 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 57.48 164.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.206 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.5 169.47 13.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.774 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -64.65 -28.95 69.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.1 t -79.33 -35.49 40.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.061 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.55 -50.31 73.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.949 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -76.31 -44.82 35.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.706 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.4 tp -55.43 -40.56 71.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.922 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -39.13 69.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.006 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -31.55 62.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.57 -45.71 92.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.61 60.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.174 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -54.07 -28.81 41.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 m -58.95 159.92 6.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.32 -30.19 11.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.128 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.435 HG21 ' HB ' ' A' ' 23' ' ' THR . 13.0 t -126.34 146.78 49.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 111.134 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 47.5 mm -74.69 -32.91 30.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.134 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.98 -51.02 65.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.364 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.435 ' HB ' HG21 ' A' ' 20' ' ' THR . 0.9 OUTLIER -61.69 -41.77 98.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.893 0.377 . . . . 0.0 110.238 179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.609 ' HA ' HG22 ' A' ' 27' ' ' VAL . 1.4 mt -59.75 -36.9 77.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.26 70.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.656 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -78.64 -23.15 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.22 0.534 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.609 HG22 ' HA ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -93.23 -23.01 5.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.256 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 24' ' ' LEU . 1.8 mm -63.66 -48.19 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 8.3 mt-10 -75.25 -33.37 61.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.03 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -76.48 -47.69 22.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.861 0.362 . . . . 0.0 111.419 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 18.4 t-20 -70.5 -34.81 72.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.29 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -65.63 -36.63 84.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.39 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -1.12 57.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -86.62 -69.87 0.65 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB2' ' HB3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.71 -157.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.112 0.482 . . . . 0.0 111.558 -179.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -118.87 -178.2 3.5 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.214 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -60.73 -25.36 66.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.528 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -47.66 39.05 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.794 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.564 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -78.89 -32.81 45.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.111 0.482 . . . . 0.0 110.06 179.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.8 tt -59.6 -34.82 73.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.056 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -35.39 66.35 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.7 t -76.87 -30.52 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.369 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.402 ' CG ' ' OD1' ' A' ' 31' ' ' ASN . 12.1 t80 -75.8 -48.0 23.46 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -60.13 -47.52 85.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.013 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -58.7 -46.61 86.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.022 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.6 -29.89 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.36 -39.93 37.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.305 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -50.7 69.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -61.2 -47.11 87.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.791 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 10.4 mmp_? -60.89 -39.77 90.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.661 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.18 -30.82 62.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.4 ' CB ' HG12 ' A' ' 63' ' ' ILE . . . -66.09 -51.19 60.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.346 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -61.96 -34.04 75.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.934 0.397 . . . . 0.0 110.591 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.93 -42.17 97.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 m -82.6 -27.0 31.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.571 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.441 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.3 tpp -99.07 13.32 33.26 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 63.77 75.89 0.37 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.938 0.399 . . . . 0.0 111.376 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.463 ' HA ' ' HE3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER 51.07 31.33 6.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.133 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 3.3 tm? -119.75 117.95 29.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.012 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.3 p90 -134.73 161.09 36.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.0 t0 91.12 -24.7 0.07 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -118.68 25.32 10.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.785 0.326 . . . . 0.0 110.713 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.43 HG21 ' CD1' ' A' ' 68' ' ' TRP . 2.3 mp -67.59 110.96 6.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.107 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.65 -156.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.368 2.045 . . . . 0.0 111.998 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.9 m -102.42 -46.19 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 m -57.68 -44.07 85.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.344 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.9 t -55.92 -60.45 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.408 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . 0.445 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.55 -30.73 65.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.628 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -72.06 -28.38 63.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.22 -50.29 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.428 HG21 ' CZ3' ' A' ' 68' ' ' TRP . 17.9 tt -89.41 107.77 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.111 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.908 -179.966 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.784 0.326 . . . . 0.0 110.805 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.593 ' HA ' HG13 ' A' ' 42' ' ' VAL . 14.5 mttt -54.05 -27.19 30.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.037 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.2 t -78.19 -35.05 49.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.84 -50.41 73.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.841 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.738 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.3 m-85 -74.45 -43.73 54.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 110.406 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.528 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 58.0 tp -56.06 -43.7 78.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.812 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.68 93.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.713 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 -24.39 58.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.085 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 24' ' ' LEU . 1.2 mt -66.72 -45.79 77.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.142 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -68.12 -17.95 64.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.243 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -56.26 -22.45 30.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.245 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.8 p -50.74 176.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.485 ' HG3' HG22 ' A' ' 20' ' ' THR . 8.2 pt20 -102.4 -34.05 9.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.988 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.487 HG23 ' H ' ' A' ' 23' ' ' THR . 4.4 t -153.03 164.6 37.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.767 HG13 HD21 ' A' ' 54' ' ' LEU . 43.7 mm -74.5 -41.58 49.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.425 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.23 -48.24 71.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.173 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.487 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -78.08 -40.88 37.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.22 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.952 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.4 tm? -60.33 -38.04 82.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.14 -39.12 77.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.073 0.463 . . . . 0.0 110.528 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -59.06 -37.13 76.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.87 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.952 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.4 p -74.26 -26.44 20.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.645 HG23 ' HE1' ' A' ' 43' ' ' PHE . 23.4 mt -60.42 -38.72 78.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.108 0.48 . . . . 0.0 110.234 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -70.53 -46.2 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.693 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -47.54 73.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' HD22 ' A' ' 35' ' ' LEU . 1.8 t-20 -62.12 -34.11 75.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -41.29 88.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -90.9 -21.79 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -59.63 -72.62 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.132 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.3 -156.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.158 0.504 . . . . 0.0 111.421 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 m -118.66 -178.21 3.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.242 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.91 -25.22 64.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -73.19 -48.06 38.39 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.767 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -79.58 -29.72 41.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.242 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.821 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.5 tt -61.35 -36.22 79.59 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.028 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.86 -37.41 68.73 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.738 HG12 ' HB2' ' A' ' 11' ' ' TYR . 12.5 t -77.04 -30.69 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.581 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.645 ' HE1' HG23 ' A' ' 28' ' ' ILE . 25.2 t80 -75.89 -37.98 58.27 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.829 0.347 . . . . 0.0 111.249 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.81 -48.11 48.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 96.8 p -62.11 -33.11 73.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -76.21 -37.72 57.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.173 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.94 -28.23 69.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.219 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -75.03 -46.27 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.052 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -42.25 71.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 109.84 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -48.11 73.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.329 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.876 HD21 HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -57.93 -37.03 73.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.919 179.314 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.961 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -61.1 -51.1 70.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.424 ' HB3' ' HB3' ' A' ' 60' ' ' TYR . 7.7 pt-20 -64.4 -29.6 70.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.624 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.767 HD21 HG13 ' A' ' 21' ' ' ILE . 1.7 mp -59.91 -35.29 74.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.917 0.389 . . . . 0.0 110.25 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.817 ' OG1' HD13 ' A' ' 71' ' ' ILE . 74.4 m -82.11 -34.81 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.475 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.649 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.4 tpp -96.52 20.08 11.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 1.4 m-20 77.45 -72.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.173 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER -151.23 34.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.666 0.269 . . . . 0.0 111.211 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.625 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.4 tm? -117.22 117.99 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 0.0 111.47 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.484 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.1 p90 -134.93 161.13 36.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.674 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 10.3 t0 88.1 -25.27 0.09 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.23 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.12 19.5 14.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.907 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.961 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.2 mp -63.39 119.42 53.11 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.786 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.788 ' HG2' HG23 ' A' ' 67' ' ' VAL . 68.8 Cg_endo -73.88 -167.79 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.448 2.099 . . . . 0.0 112.352 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.0 p -88.72 -26.45 21.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.1 m -71.27 -46.36 61.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.098 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.788 HG23 ' HG2' ' A' ' 64' ' ' PRO . 41.4 t -63.64 -48.64 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -56.51 -27.75 58.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.91 -50.16 15.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.264 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.876 HG12 HD21 ' A' ' 51' ' ' LEU . 1.3 tt . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.891 0.376 . . . . 0.0 111.42 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.892 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -59.85 -30.0 68.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.066 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.43 -29.38 41.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.16 -50.33 70.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.084 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.785 ' HB2' HG12 ' A' ' 42' ' ' VAL . 5.2 m-85 -73.83 -43.16 59.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.838 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.765 HD11 ' CD2' ' A' ' 49' ' ' HIS . 1.5 tp -55.35 -41.48 72.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.987 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.411 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.39 -42.49 59.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.078 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.04 -39.14 89.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.99 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.536 HD13 ' CB ' ' A' ' 46' ' ' ALA . 0.5 OUTLIER -59.49 -44.7 93.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -74.85 -25.54 59.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.969 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -56.68 -22.46 35.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.288 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.4 173.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.775 0.322 . . . . 0.0 111.145 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -101.38 -38.08 8.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.183 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 23' ' ' THR . 13.3 t -140.85 159.96 41.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.1 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.602 ' CD1' HD11 ' A' ' 54' ' ' LEU . 47.3 mm -74.49 -37.76 44.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.345 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -53.98 -50.94 65.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.642 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -72.96 -30.37 63.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.905 0.383 . . . . 0.0 110.514 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.962 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -70.26 -39.13 75.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.663 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -58.03 -39.31 78.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.102 0.477 . . . . 0.0 110.533 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -35.03 71.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.728 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.962 HG12 ' O ' ' A' ' 24' ' ' LEU . 5.8 p -77.47 -26.41 15.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.093 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.463 HD11 ' CD1' ' A' ' 24' ' ' LEU . 35.9 mt -59.18 -39.01 77.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.977 0.417 . . . . 0.0 110.42 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.54 -43.53 55.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.821 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 mmtp -65.69 -47.6 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.454 ' CB ' ' CE2' ' A' ' 43' ' ' PHE . 2.6 m120 -68.38 -31.7 71.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.084 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.72 -36.16 78.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.084 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.35 -22.01 16.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER -57.55 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.227 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.777 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.93 -156.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.229 0.538 . . . . 0.0 111.553 -179.75 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.496 ' N ' HD23 ' A' ' 35' ' ' LEU . 6.8 m -118.67 -178.24 3.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.128 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -59.55 -25.01 64.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.88 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -73.15 -48.32 36.51 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.718 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -79.7 -30.31 40.98 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.412 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.767 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.2 tt -57.99 -35.03 70.63 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.834 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -30.88 62.14 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.892 HG13 ' HA ' ' A' ' 8' ' ' LYS . 47.0 t -76.78 -33.4 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.23 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 31' ' ' ASN . 9.9 t80 -75.87 -43.25 46.46 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.955 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -42.29 98.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.831 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.5 p -58.38 -46.0 87.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.813 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.536 ' CB ' HD13 ' A' ' 15' ' ' LEU . . . -59.75 -29.69 68.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.998 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.09 -47.19 85.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.58 -48.67 76.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.765 ' CD2' HD11 ' A' ' 12' ' ' LEU . 28.9 t60 -60.02 -45.38 92.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -64.75 -48.13 75.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.661 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -30.67 69.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.696 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' A' ' 59' ' ' LEU . . . -61.46 -51.58 68.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.315 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.533 ' N ' ' HB2' ' A' ' 59' ' ' LEU . 2.1 tm-20 -64.4 -26.88 68.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.66 -179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.602 HD11 ' CD1' ' A' ' 21' ' ' ILE . 5.0 mt -78.36 -36.58 45.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.956 HG21 HG22 ' A' ' 71' ' ' ILE . 9.8 m -82.97 -43.4 16.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.894 ' HB3' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.61 3.49 16.71 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.431 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 53' ' ' GLU . 2.1 t30 63.88 126.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.815 0.34 . . . . 0.0 110.581 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 0.4 OUTLIER 49.47 86.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.02 0.438 . . . . 0.0 110.805 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.894 HD21 ' HB3' ' A' ' 56' ' ' MET . 4.1 mm? -119.79 148.62 43.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.666 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.546 ' O ' ' CD1' ' A' ' 63' ' ' ILE . 31.1 m-85 -83.07 161.08 21.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.913 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -61.56 -17.07 53.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.446 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.71 78.43 1.85 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.806 0.336 . . . . 0.0 111.572 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.73 ' CG1' HD12 ' A' ' 59' ' ' LEU . 1.3 mp -68.41 136.05 90.96 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.651 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.27 -157.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.473 2.115 . . . . 0.0 112.208 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 t -99.44 -34.11 10.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.2 m -59.99 -46.18 90.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.56 ' HB ' HG23 ' A' ' 63' ' ' ILE . 21.7 t -61.37 -45.55 98.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.042 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.697 ' CE3' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.8 -23.63 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.148 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -28.59 62.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.034 179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -76.39 -50.32 14.5 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.805 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.956 HG22 HG21 ' A' ' 55' ' ' THR . 7.4 pt . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.762 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.902 0.382 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.907 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.8 -34.5 71.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.41 -30.04 42.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.055 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -61.92 -50.35 72.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.187 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.608 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.8 m-30 -68.18 -51.95 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' HB1' ' A' ' 46' ' ' ALA . 1.2 tt -55.37 -45.04 76.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.047 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -45.32 71.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.919 0.39 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -29.52 70.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.905 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.555 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -63.15 -45.96 89.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.053 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -67.86 -16.87 64.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.274 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -53.95 -24.66 17.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.43 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.74 168.76 4.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.876 0.369 . . . . 0.0 111.105 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -41.76 6.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.951 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.605 HG23 ' H ' ' A' ' 23' ' ' THR . 12.8 t -129.16 150.72 50.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.783 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' NH2' ' A' ' 50' ' ' ARG . 39.0 mm -67.56 -39.61 82.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.767 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.99 -51.03 65.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.665 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.605 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -74.61 -29.42 61.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.436 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.737 HD23 ' O ' ' A' ' 24' ' ' LEU . 3.0 tt -69.76 -38.66 76.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.587 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.48 -30.15 64.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.041 0.448 . . . . 0.0 110.456 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -60.26 -33.09 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -77.06 -31.36 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.079 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.402 ' CD1' ' CD2' ' A' ' 24' ' ' LEU . 1.7 mp -59.15 -33.31 50.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 110.194 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 1.0 OUTLIER -74.78 -49.0 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.949 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -33.08 72.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG22 ' A' ' 27' ' ' VAL . 47.1 m-20 -74.3 -42.46 59.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.26 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -59.85 -30.16 68.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.892 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.429 ' N ' ' HG3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -98.72 -5.74 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.409 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -70.16 0.52 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.797 0.332 . . . . 0.0 111.232 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.962 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.26 -160.42 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.285 0.564 . . . . 0.0 111.97 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -119.17 -178.03 3.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.164 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.65 -25.29 66.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.378 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -72.36 -47.49 49.17 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.733 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.962 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.9 tp10 -78.79 -29.67 45.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.928 0.394 . . . . 0.0 110.201 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HA ' HD11 ' A' ' 35' ' ' LEU . 1.1 tt -57.17 -31.21 65.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.715 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.02 -32.4 63.96 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.907 HG13 ' HA ' ' A' ' 8' ' ' LYS . 72.4 t -76.84 -32.79 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.042 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -75.94 -42.63 48.13 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.868 0.366 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.48 -48.13 68.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.1 t -58.87 -46.52 87.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.853 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.55 ' HB1' ' HG ' ' A' ' 12' ' ' LEU . . . -71.02 -28.57 64.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.149 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.406 ' O ' HD23 ' A' ' 51' ' ' LEU . . . -61.31 -66.34 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.334 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -54.94 -43.66 73.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.183 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -51.6 67.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.837 0.351 . . . . 0.0 110.459 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.413 ' NH2' ' CD1' ' A' ' 21' ' ' ILE . 0.7 OUTLIER -61.24 -40.75 95.21 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.119 0.485 . . . . 0.0 109.955 179.161 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -66.71 -34.8 78.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.159 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.937 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -65.34 -51.04 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.15 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.431 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.7 pt-20 -56.93 -41.89 79.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.859 0.361 . . . . 0.0 110.465 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.12 -29.04 65.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.205 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.412 HG21 HG12 ' A' ' 67' ' ' VAL . 2.7 m -82.34 -36.01 27.29 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.092 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.763 ' SD ' HG11 ' A' ' 67' ' ' VAL . 11.4 mmm -93.12 17.96 10.09 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 m120 64.38 62.71 0.8 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.962 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? 64.71 27.23 13.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.977 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.802 HD22 ' N ' ' A' ' 60' ' ' TYR . 1.0 OUTLIER -119.96 121.51 39.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.94 0.4 . . . . 0.0 111.372 179.455 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.802 ' N ' HD22 ' A' ' 59' ' ' LEU . 4.4 p90 -126.35 161.47 27.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.563 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 1.1 t70 87.7 -7.75 0.59 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.027 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.649 ' HB2' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -128.6 13.62 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.704 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.937 HG12 ' HB1' ' A' ' 52' ' ' ALA . 1.8 mp -65.2 118.2 47.44 Favored Pre-proline 0 C--N 1.333 -0.127 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.903 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.692 ' HG2' HG23 ' A' ' 67' ' ' VAL . 61.9 Cg_endo -73.25 -168.17 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.407 2.071 . . . . 0.0 112.22 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -92.34 -28.61 16.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.6 m -68.39 -46.2 70.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.763 HG11 ' SD ' ' A' ' 56' ' ' MET . 23.3 t -69.19 -49.43 61.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.105 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.71 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -57.65 -40.58 79.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -63.03 -30.89 71.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.779 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -70.9 -50.18 37.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.446 HG23 ' CE3' ' A' ' 68' ' ' TRP . 2.4 tt . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.064 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.832 0.348 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HA ' HG13 ' A' ' 42' ' ' VAL . 28.1 mttt -59.14 -38.88 80.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.742 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -42.79 85.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.003 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.1 -50.37 69.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.007 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.417 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -76.6 -44.26 35.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.971 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.692 HD23 ' O ' ' A' ' 46' ' ' ALA . 2.9 tm? -55.38 -47.32 76.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.293 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -69.72 -31.17 69.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.777 0.323 . . . . 0.0 110.935 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -77.9 -29.69 50.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.023 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.967 HD23 HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -66.28 -45.81 79.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.077 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -18.03 63.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -23.65 19.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.26 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -173.1 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -102.29 -39.93 6.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 23' ' ' THR . 13.6 t -139.2 150.64 45.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.101 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 21' ' ' ILE . 3.3 mp -74.63 -32.49 29.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.864 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -55.87 -50.96 69.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.641 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -63.47 -45.46 90.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.494 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.967 HD13 HD23 ' A' ' 15' ' ' LEU . 1.9 mt -56.04 -31.49 63.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -39.85 79.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.091 0.472 . . . . 0.0 109.823 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -48.18 77.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.23 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.796 ' CG1' HD23 ' A' ' 24' ' ' LEU . 3.8 p -71.75 -23.85 22.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.5 HD12 ' CZ ' ' A' ' 43' ' ' PHE . 1.1 tp -59.16 -38.48 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.337 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -43.51 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.691 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -64.64 -47.45 78.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 1.1 t-20 -59.01 -34.61 72.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.903 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.41 ' O ' HD12 ' A' ' 40' ' ' LEU . 12.3 mtpt -58.63 -47.22 85.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.656 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -88.54 -7.09 57.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.123 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -74.55 -67.62 0.61 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.128 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.782 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.23 -155.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.193 0.521 . . . . 0.0 111.388 -179.804 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 35' ' ' LEU . 22.9 t -118.56 -178.25 3.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.168 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.0 -25.08 64.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.837 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -72.76 -48.26 39.88 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.734 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -79.79 -29.83 40.47 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.513 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.782 ' HB2' HD21 ' A' ' 35' ' ' LEU . 8.2 tt -58.93 -36.72 75.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.874 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.52 66.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.549 HG13 ' HA ' ' A' ' 8' ' ' LYS . 8.0 t -76.95 -30.69 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.295 178.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.5 ' CZ ' HD12 ' A' ' 28' ' ' ILE . 7.3 t80 -75.81 -42.37 50.13 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.086 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -65.96 -48.01 72.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.944 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.5 p -67.79 -46.26 72.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.996 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -65.86 -34.93 79.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.63 -24.47 58.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.403 ' OD2' ' CZ2' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -73.64 -50.82 19.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.055 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.48 -51.8 65.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.069 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.624 ' CD ' HD22 ' A' ' 15' ' ' LEU . 5.0 ptm85 -54.75 -40.73 69.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.208 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -47.88 35.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.872 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.704 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.62 -49.38 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.413 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -64.73 -29.44 70.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.171 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -65.8 -28.91 69.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.129 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.9 m -80.11 -39.01 30.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.491 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.601 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.7 tpp -99.67 4.67 45.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.783 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.8 t30 77.27 91.79 0.07 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.971 0.415 . . . . 0.0 111.79 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.6 OUTLIER 40.34 48.97 2.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.468 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.575 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 2.5 tm? -119.96 118.07 29.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.695 0.284 . . . . 0.0 111.142 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.553 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.1 OUTLIER -132.79 160.48 36.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 110.979 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.0 t0 74.92 4.95 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.888 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.25 7.44 1.02 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.704 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.7 mp -63.34 110.61 3.8 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.43 -178.44 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.519 2.146 . . . . 0.0 112.245 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.82 -46.45 14.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.73 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -46.2 69.76 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.067 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.601 HG21 ' CE ' ' A' ' 56' ' ' MET . 21.9 t -59.65 -55.12 25.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.469 ' CE3' HG23 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.86 -44.42 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.588 179.667 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -32.98 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.003 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -70.06 -50.22 43.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 71' ' ' ILE . 14.2 tt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.207 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.458 -0.035 0 CA-C-O 120.893 0.377 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.851 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -51.75 -32.42 30.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.174 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.31 -35.89 40.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.03 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.1 -50.36 74.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.14 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.489 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -69.69 -52.03 29.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.825 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.597 HD23 ' O ' ' A' ' 12' ' ' LEU . 5.2 tt -56.0 -40.59 73.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -42.92 84.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.5 mtt180 -76.28 -27.81 56.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -59.36 -42.73 92.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -69.19 -22.23 63.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -56.06 -22.65 28.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.287 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.818 ' SG ' HD12 ' A' ' 24' ' ' LEU . 31.0 p -49.63 172.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.28 -35.22 8.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.611 HG23 ' H ' ' A' ' 23' ' ' THR . 14.9 t -150.01 159.7 44.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.88 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 54' ' ' LEU . 41.1 mm -74.44 -39.34 48.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.596 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.9 -50.94 65.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.611 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -70.68 -29.02 65.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.661 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.884 ' O ' HG12 ' A' ' 27' ' ' VAL . 5.2 tt -74.66 -36.07 62.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -57.48 -32.47 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 0.0 110.195 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -64.5 -33.8 76.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.197 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.884 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.1 p -80.98 -26.8 10.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.204 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 24' ' ' LEU . 29.5 mt -59.01 -40.27 80.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.978 0.418 . . . . 0.0 110.313 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -74.73 -41.73 59.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.838 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -68.61 -47.68 66.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.243 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.464 ' HB2' ' CE2' ' A' ' 43' ' ' PHE . 2.3 m120 -66.08 -31.65 72.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.61 -48.1 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.139 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.16 -2.38 58.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.783 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 3.2 mt-10 -79.36 -77.86 0.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.759 0.314 . . . . 0.0 110.952 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.969 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.78 -157.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.204 0.526 . . . . 0.0 111.577 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.2 m -118.76 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.306 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -60.69 -25.4 66.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.536 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -73.67 -47.52 39.1 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.816 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.969 ' CG ' HD12 ' A' ' 35' ' ' LEU . 2.7 tp10 -78.86 -34.99 44.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.993 0.425 . . . . 0.0 110.15 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.71 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.8 tt -57.99 -34.73 70.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.332 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -34.53 65.27 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 8' ' ' LYS . 65.0 t -76.96 -33.29 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.337 178.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 31' ' ' ASN . 8.9 t80 -76.1 -48.07 22.12 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.436 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.65 -48.3 81.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.5 p -67.96 -37.17 81.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.652 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.18 -40.16 46.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.789 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.28 -34.71 59.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.855 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.45 ' HB3' ' CH2' ' A' ' 68' ' ' TRP . 10.6 m-20 -72.0 -50.69 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.56 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.85 -45.14 74.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.129 0.49 . . . . 0.0 110.019 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -64.16 -47.86 78.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.681 0.753 . . . . 0.0 109.588 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.895 ' O ' HD22 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -60.89 -33.8 73.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.662 -1.153 . . . . 0.0 110.341 179.714 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.957 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -63.83 -51.32 65.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.099 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.419 ' O ' ' N ' ' A' ' 58' ' ' LYS . 5.0 pt-20 -57.34 -41.89 80.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.738 0.304 . . . . 0.0 110.767 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.434 HD11 HD11 ' A' ' 21' ' ' ILE . 2.8 mt -58.69 -31.78 68.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.921 0.391 . . . . 0.0 110.623 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.62 -33.19 27.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.951 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.804 ' HG2' HD12 ' A' ' 59' ' ' LEU . 9.9 tpp -95.99 15.93 19.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.496 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 65.87 68.86 0.46 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.045 0.45 . . . . 0.0 111.168 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 55.91 28.79 13.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.673 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.804 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.2 tm? -119.83 118.57 31.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.893 0.377 . . . . 0.0 111.485 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -128.57 161.23 30.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.666 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.499 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 13.8 t0 89.72 -12.41 0.35 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.692 ' HB3' HD11 ' A' ' 59' ' ' LEU . 3.8 tmmt? -131.24 20.48 4.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.734 0.302 . . . . 0.0 110.801 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.957 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.9 mp -62.21 110.69 3.53 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.034 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.485 ' HB2' HG23 ' A' ' 67' ' ' VAL . 52.0 Cg_exo -55.23 166.02 2.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.47 2.114 . . . . 0.0 112.263 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.8 m -74.92 -40.26 60.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.931 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -43.74 98.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.929 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.72 HG11 ' CE ' ' A' ' 56' ' ' MET . 14.5 t -65.71 -51.29 63.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.729 ' CH2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -57.67 -42.33 83.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -60.61 -30.57 69.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.731 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -75.96 -50.29 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.807 ' CD1' HD21 ' A' ' 51' ' ' LEU . 1.5 tt . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.183 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.414 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.85 0.357 . . . . 0.0 110.722 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.868 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.9 OUTLIER -51.69 -37.54 51.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 -179.649 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.66 -29.23 40.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.414 ' HB2' ' N ' ' A' ' 7' ' ' THR . 3.3 m-20 -55.07 -50.79 68.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.654 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.707 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -76.75 -36.91 56.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.683 0.278 . . . . 0.0 111.065 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 8' ' ' LYS . 13.7 mt -55.14 -47.5 75.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.131 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 34.7 mtm -76.92 -41.8 41.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -60.58 -37.06 80.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.807 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.54 HD22 ' HD2' ' A' ' 50' ' ' ARG . 1.7 tt -64.28 -45.77 86.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.81 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -71.86 -22.61 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.964 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.62 -27.11 57.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.215 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 167.57 0.46 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -96.59 -41.4 8.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.119 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.618 HG23 ' H ' ' A' ' 23' ' ' THR . 9.9 t -131.43 160.81 34.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.408 HG13 HD21 ' A' ' 54' ' ' LEU . 44.6 mm -74.51 -41.15 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.294 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.2 -50.89 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.032 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.618 ' H ' HG23 ' A' ' 20' ' ' THR . 0.7 OUTLIER -64.85 -44.52 89.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.009 0.433 . . . . 0.0 110.454 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.935 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -58.38 -38.79 78.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -57.96 -38.11 75.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.087 0.47 . . . . 0.0 110.549 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -59.06 -38.84 80.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.635 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.935 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.3 p -72.97 -26.01 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.538 HG23 ' HE1' ' A' ' 43' ' ' PHE . 22.7 mt -61.63 -38.17 79.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.952 0.406 . . . . 0.0 110.481 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 6.0 tt0 -74.14 -36.41 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -36.11 60.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.854 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.567 ' O ' HD22 ' A' ' 35' ' ' LEU . 2.4 m120 -78.55 -42.56 28.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.325 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HA ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.57 -36.16 73.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.019 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -87.93 -19.87 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -68.42 -78.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.23 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.94 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.38 -158.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.214 0.53 . . . . 0.0 111.559 -179.687 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -178.11 3.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.325 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.35 -25.39 65.8 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.588 179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -74.16 -47.45 35.75 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.894 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.94 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -78.94 -33.92 44.94 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.005 0.431 . . . . 0.0 110.071 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.685 ' HA ' HD11 ' A' ' 35' ' ' LEU . 7.5 tt -58.33 -32.97 68.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -30.57 61.8 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.868 HG13 ' HA ' ' A' ' 8' ' ' LYS . 89.0 t -76.84 -34.43 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.171 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HE1' HG23 ' A' ' 28' ' ' ILE . 13.1 t80 -75.98 -47.96 22.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.965 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.44 -42.61 87.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 39.8 m -60.01 -42.63 94.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.957 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -74.73 -30.64 61.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.309 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.07 -50.42 19.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.227 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.76 -48.05 80.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.01 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.5 m170 -56.05 -39.48 72.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.993 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.54 ' HD2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -70.52 -39.51 74.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.89 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.28 60.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.778 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.909 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.8 -51.18 70.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.245 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.802 ' HA ' HD23 ' A' ' 59' ' ' LEU . 24.6 pt-20 -61.94 -42.12 98.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.047 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -61.95 -28.67 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.9 m -65.17 -42.92 93.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.636 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.865 ' HB3' HD22 ' A' ' 59' ' ' LEU . 32.2 ttm -99.61 -30.76 11.94 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.612 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' MET . 4.5 m-20 156.94 -74.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.244 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -153.0 32.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.5 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.865 HD22 ' HB3' ' A' ' 56' ' ' MET . 0.2 OUTLIER -88.57 139.74 30.17 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.591 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.739 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -135.04 154.18 51.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.832 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.79 -62.09 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -56.96 -5.53 0.25 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.32 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.909 HG12 ' HB1' ' A' ' 52' ' ' ALA . 5.3 mp -60.94 110.26 2.82 Favored Pre-proline 0 C--N 1.33 -0.274 0 C-N-CA 121.167 -0.213 . . . . 0.0 110.712 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -66.65 -158.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.637 2.225 . . . . 0.0 112.067 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -98.2 -25.03 15.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.829 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.466 ' HA ' ' HG2' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -69.86 -46.15 66.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.969 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.86 -40.22 80.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.679 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -65.63 -39.1 91.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.964 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.466 ' HG2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -66.27 -27.27 67.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.014 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.417 ' N ' ' HG3' ' A' ' 69' ' ' LYS . 12.3 t80 -66.31 -50.22 64.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 tt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.939 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.824 0.345 . . . . 0.0 110.709 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.965 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -53.82 -31.71 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.228 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -36.09 55.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.476 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 6.2 m-20 -54.83 -50.32 68.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.383 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.686 ' HB2' HG12 ' A' ' 42' ' ' VAL . 8.1 m-85 -74.84 -38.38 62.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.87 0.367 . . . . 0.0 110.91 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.586 HD13 ' C ' ' A' ' 12' ' ' LEU . 2.3 tm? -55.5 -47.44 76.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.43 ' HE3' ' HB2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.19 -32.64 63.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 0.0 111.08 -179.841 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 1.4 ttt180 -74.02 -23.91 59.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.923 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.806 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -72.94 -45.74 56.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.938 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -64.01 -17.17 63.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.499 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -54.05 -26.6 27.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.754 0.312 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.66 165.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.826 0.346 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -78.03 -40.68 38.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 23' ' ' THR . 14.2 t -149.93 165.74 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.651 HG12 HD21 ' A' ' 54' ' ' LEU . 2.0 mp -74.52 -29.93 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.39 -50.5 67.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.93 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.432 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -75.99 -32.51 59.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.198 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.896 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.68 -36.18 81.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.444 179.622 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 28' ' ' ILE . 3.9 tp10 -57.15 -31.82 65.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.234 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -65.15 -34.95 79.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.114 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.896 HG12 ' O ' ' A' ' 24' ' ' LEU . 8.6 p -79.84 -27.28 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.07 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 24' ' ' LEU . 39.0 mm -58.14 -39.91 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-O 121.113 0.482 . . . . 0.0 110.233 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -74.18 -43.18 58.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.563 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -64.17 -47.59 79.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.101 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 43' ' ' PHE . 0.7 OUTLIER -66.86 -31.66 72.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.031 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -58.55 -40.34 82.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.952 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -98.99 -0.06 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.507 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -78.91 -68.92 0.61 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.693 0.283 . . . . 0.0 111.216 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.786 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -72.67 -156.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.217 0.532 . . . . 0.0 111.611 -179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.51 ' N ' HD23 ' A' ' 35' ' ' LEU . 32.6 t -118.71 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.098 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 p30 -59.65 -25.03 64.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -48.41 39.4 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.719 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.73 -29.92 40.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.962 0.41 . . . . 0.0 110.318 179.556 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.765 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.9 tt -57.41 -32.81 67.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.788 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.01 -35.59 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.965 HG13 ' HA ' ' A' ' 8' ' ' LYS . 57.9 t -76.78 -30.83 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.143 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 31' ' ' ASN . 8.9 t80 -75.83 -41.35 52.84 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.54 -48.18 80.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.5 p -59.95 -35.81 75.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.912 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.49 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -77.23 -29.71 54.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.242 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.23 -52.56 9.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.195 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.74 -44.72 90.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.995 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -58.78 -49.04 79.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.966 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.48 ' HG3' HD22 ' A' ' 15' ' ' LEU . 9.9 mmt180 -61.67 -44.71 96.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -30.71 69.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.896 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.54 -50.98 69.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.222 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.98 -30.68 71.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.856 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 HG12 ' A' ' 21' ' ' ILE . 2.3 mp -60.55 -35.59 76.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.688 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -78.74 -36.3 43.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.986 ' HE1' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -96.92 20.87 10.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 78.48 -63.92 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.859 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -160.5 40.84 0.17 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.077 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.59 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.6 tm? -119.76 117.87 29.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 111.261 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.0 p90 -135.04 161.13 36.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.767 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.482 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 3.1 t0 89.08 -30.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.225 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -112.25 26.56 10.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.765 0.317 . . . . 0.0 110.893 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.986 HG23 ' HE1' ' A' ' 56' ' ' MET . 1.9 mp -72.22 118.24 65.59 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.035 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.781 ' HG2' HG23 ' A' ' 67' ' ' VAL . 74.5 Cg_endo -74.68 -167.61 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.416 2.077 . . . . 0.0 112.294 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -90.57 -26.63 19.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 92.0 p -70.17 -46.18 65.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.781 HG23 ' HG2' ' A' ' 64' ' ' PRO . 42.2 t -63.5 -54.96 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.53 -34.3 68.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.903 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -68.33 -30.32 69.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.87 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -73.95 -49.78 23.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.558 HD13 ' C ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.953 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 72.0 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.782 0.325 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.862 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.65 -35.17 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.47 -34.64 41.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.05 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.97 -50.5 68.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.174 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.605 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.9 m-85 -76.56 -43.76 37.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.428 . . . . 0.0 110.704 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.619 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.5 tm? -55.93 -47.08 78.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.228 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -31.21 69.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.3 mtt-85 -77.86 -30.35 50.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.809 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -65.87 -45.65 81.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.04 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -64.6 -16.09 62.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.1 ttp85 -54.02 -28.5 38.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.777 0.322 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.65 179.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.872 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -99.22 -36.05 9.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.97 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 23' ' ' THR . 14.6 t -147.02 157.79 43.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.594 ' N ' HD12 ' A' ' 21' ' ' ILE . 1.8 mp -73.77 -29.51 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.793 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.55 -49.9 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.732 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.614 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -76.4 -32.24 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.052 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.921 HD23 ' CG1' ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.18 -35.69 81.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.401 179.571 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.16 -31.84 65.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.234 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -66.21 -37.87 86.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.223 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.921 ' CG1' HD23 ' A' ' 24' ' ' LEU . 9.1 p -75.39 -27.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.611 HG23 ' HE1' ' A' ' 43' ' ' PHE . 35.7 mm -58.8 -42.41 85.43 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.999 0.428 . . . . 0.0 110.107 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -45.55 78.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -46.47 89.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.813 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 3.0 t-20 -75.22 -31.32 60.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.732 ' HD2' HD11 ' A' ' 40' ' ' LEU . 13.7 tptt -58.23 -30.41 66.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -106.26 -6.56 18.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.322 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -73.11 -69.04 0.44 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.645 0.26 . . . . 0.0 111.231 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.6 -156.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 111.527 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.505 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -118.61 -178.16 3.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.191 179.395 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -25.03 64.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.86 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -72.84 -48.33 38.6 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.72 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.83 -29.94 40.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.956 0.408 . . . . 0.0 110.535 179.7 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.804 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.9 tt -58.34 -34.59 70.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.022 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -36.51 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.862 HG13 ' HA ' ' A' ' 8' ' ' LYS . 43.3 t -76.97 -30.98 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.361 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.611 ' HE1' HG23 ' A' ' 28' ' ' ILE . 27.7 t80 -75.85 -48.04 23.1 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.136 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -57.98 -47.51 82.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 89.6 p -59.99 -35.43 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.619 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -67.63 -42.11 82.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.17 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.27 -34.16 42.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.71 -50.77 69.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.25 -44.9 94.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 39.3 tpt85 -60.0 -40.78 90.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.656 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.481 HD23 ' CG2' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -73.94 -39.74 63.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.791 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.9 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -59.27 -50.84 72.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.135 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 2.0 pt-20 -65.36 -27.04 68.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.298 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.32 -28.92 68.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.823 0.344 . . . . 0.0 110.926 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.526 HG21 HG12 ' A' ' 71' ' ' ILE . 59.3 m -82.82 -42.76 17.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.683 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.443 ' HB3' ' CB ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -98.94 5.87 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.388 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 71.8 103.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.941 0.401 . . . . 0.0 111.675 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 1.6 mmpt? 42.37 40.4 1.83 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.497 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.582 ' O ' HD11 ' A' ' 63' ' ' ILE . 1.7 tm? -112.57 121.06 43.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.03 0.443 . . . . 0.0 110.96 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.805 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.45 157.64 40.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.773 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 65.18 -62.87 0.2 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 60' ' ' TYR . 16.4 mttt -53.53 -11.64 0.37 Allowed 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.9 HG12 ' HB1' ' A' ' 52' ' ' ALA . 4.9 mp -60.86 116.88 20.64 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.603 0.24 . . . . 0.0 110.826 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.777 ' HG2' HG23 ' A' ' 67' ' ' VAL . 80.1 Cg_endo -78.19 -167.34 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.551 2.167 . . . . 0.0 112.372 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 -39.87 22.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 95.0 p -59.32 -46.27 89.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.777 HG23 ' HG2' ' A' ' 64' ' ' PRO . 38.8 t -67.83 -43.7 85.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.955 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.596 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -62.77 -33.6 75.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -43.29 98.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.757 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -70.25 -39.7 74.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.811 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.587 HD11 HG12 ' A' ' 67' ' ' VAL . 20.0 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.015 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.846 0.355 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.888 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -63.34 -29.92 71.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.085 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -29.38 42.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.1 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.79 -50.44 72.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.015 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.564 ' HB2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -76.49 -44.53 34.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.763 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 59.2 tp -55.42 -36.87 66.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.048 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -45.86 67.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.064 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -67.7 -30.99 70.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -45.66 92.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.64 -13.96 61.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.391 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.62 -44.0 69.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.49 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 141.19 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.861 0.362 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -79.89 -36.66 36.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -105.02 147.22 28.06 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 120.838 0.352 . . . . 0.0 110.686 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 40.4 mm -74.43 -45.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.276 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -54.07 -51.0 65.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.949 0.404 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.71 -31.78 58.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.871 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.899 ' O ' HG12 ' A' ' 27' ' ' VAL . 3.4 tm? -83.62 -38.19 21.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.798 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -33.56 68.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.055 0.455 . . . . 0.0 110.384 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -64.46 -35.01 79.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.333 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.899 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.8 p -79.02 -24.67 12.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.931 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 24' ' ' LEU . 25.8 mt -62.07 -38.93 82.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 121.003 0.43 . . . . 0.0 110.439 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -74.72 -43.4 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.147 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -70.41 -36.11 73.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.351 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB3' ' CE2' ' A' ' 43' ' ' PHE . 26.2 t-20 -78.28 -41.61 33.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.624 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.65 -31.91 68.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 110.895 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.439 ' CD2' ' HE2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -92.23 -15.48 27.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -73.57 -71.68 0.3 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.288 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.979 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -62.08 -160.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.078 0.466 . . . . 0.0 111.792 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 t -119.16 -178.19 3.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -59.8 -25.23 64.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.541 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -73.71 -47.49 39.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.795 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.979 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -79.04 -35.45 42.6 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 120.986 0.422 . . . . 0.0 110.14 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.616 ' HA ' HD11 ' A' ' 35' ' ' LEU . 5.6 tt -59.64 -31.16 69.26 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.996 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.03 -36.0 67.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.888 HG13 ' HA ' ' A' ' 8' ' ' LYS . 91.7 t -76.92 -30.76 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.924 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.461 ' CE2' ' HB3' ' A' ' 31' ' ' ASN . 5.9 t80 -74.27 -48.0 31.43 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.4 ' HB2' HD23 ' A' ' 40' ' ' LEU . 2.6 t80 -60.12 -47.99 83.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.137 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -37.02 79.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.988 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.763 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -70.58 -33.82 71.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.53 -37.2 71.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.151 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -45.43 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -58.23 -47.41 83.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.923 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -37.27 83.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.739 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -30.62 62.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.729 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.915 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.78 -51.17 68.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.489 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -30.91 70.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.81 -40.66 89.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.979 0.418 . . . . 0.0 110.483 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.5 HG21 HG12 ' A' ' 71' ' ' ILE . 86.7 m -82.55 -31.51 29.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.59 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.49 ' HG2' HD12 ' A' ' 59' ' ' LEU . 1.3 tpp -95.59 20.91 8.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.074 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.24 -68.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.947 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -159.04 39.43 0.22 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.057 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.0 tm? -119.76 117.85 29.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 111.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.461 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -135.22 161.44 35.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.567 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.9 t70 87.05 -42.41 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.032 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 17.46 13.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.08 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.915 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.5 mp -61.84 110.58 3.33 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.884 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.14 -177.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.391 2.061 . . . . 0.0 112.127 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 95.2 p -89.81 -30.68 17.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.912 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 t -73.57 -42.81 61.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.717 HG12 HD11 ' A' ' 71' ' ' ILE . 24.5 t -57.22 -58.54 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.273 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.461 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.79 -34.14 69.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.803 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -40.24 89.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -75.61 -42.92 50.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.717 HD11 HG12 ' A' ' 67' ' ' VAL . 10.3 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.757 0.313 . . . . 0.0 110.774 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HA ' HG13 ' A' ' 42' ' ' VAL . 17.0 mttp -64.65 -28.95 69.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.1 t -79.33 -35.49 40.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.061 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.55 -50.31 73.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.949 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.687 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.6 m-85 -76.31 -44.82 35.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.706 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.745 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 12.4 tp -55.43 -40.56 71.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -39.13 69.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.006 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -31.55 62.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.624 HD22 ' HG3' ' A' ' 50' ' ' ARG . 0.3 OUTLIER -60.57 -45.71 92.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.61 60.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.174 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -54.07 -28.81 41.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 m -58.95 159.92 6.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.32 -30.19 11.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.128 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 23' ' ' THR . 13.0 t -126.34 146.78 49.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 111.134 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.604 HG13 HD21 ' A' ' 54' ' ' LEU . 47.5 mm -74.69 -32.91 30.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.134 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.98 -51.02 65.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.364 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.594 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -61.69 -41.77 98.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.893 0.377 . . . . 0.0 110.238 179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.939 HD22 HD11 ' A' ' 28' ' ' ILE . 1.4 mt -59.75 -36.9 77.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.26 70.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.656 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -78.64 -23.15 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.22 0.534 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.72 HG23 ' HA ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -93.23 -23.01 5.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.256 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.939 HD11 HD22 ' A' ' 24' ' ' LEU . 1.8 mm -63.66 -48.19 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 8.3 mt-10 -75.25 -33.37 61.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.03 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -76.48 -47.69 22.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.861 0.362 . . . . 0.0 111.419 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 18.4 t-20 -70.5 -34.81 72.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.29 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -65.63 -36.63 84.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.39 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -1.12 57.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -86.62 -69.87 0.65 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.937 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.71 -157.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.112 0.482 . . . . 0.0 111.558 -179.686 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -118.87 -178.2 3.5 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.214 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -60.73 -25.36 66.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.528 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -47.66 39.05 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.794 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.937 ' CG ' HD12 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -78.89 -32.81 45.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.111 0.482 . . . . 0.0 110.06 179.583 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.8 tt -59.6 -34.82 73.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.056 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -35.39 66.35 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.74 HG13 ' HA ' ' A' ' 8' ' ' LYS . 25.7 t -76.87 -30.52 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.369 178.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.402 ' CG ' ' OD1' ' A' ' 31' ' ' ASN . 12.1 t80 -75.8 -48.0 23.46 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -60.13 -47.52 85.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.013 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -58.7 -46.61 86.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.022 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.745 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -71.6 -29.89 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.182 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.36 -39.93 37.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.305 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -50.7 69.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -61.2 -47.11 87.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.791 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.624 ' HG3' HD22 ' A' ' 15' ' ' LEU . 10.4 mmp_? -60.89 -39.77 90.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.661 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.18 -30.82 62.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.904 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -66.09 -51.19 60.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.346 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -61.96 -34.04 75.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.934 0.397 . . . . 0.0 110.591 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.604 HD21 HG13 ' A' ' 21' ' ' ILE . 1.3 tp -60.93 -42.17 97.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 m -82.6 -27.0 31.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.571 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.892 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.3 tpp -99.07 13.32 33.26 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 63.77 75.89 0.37 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.938 0.399 . . . . 0.0 111.376 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 51.07 31.33 6.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.133 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.892 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.3 tm? -119.75 117.95 29.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.012 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.3 p90 -134.73 161.09 36.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.0 t0 91.12 -24.7 0.07 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -118.68 25.32 10.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.785 0.326 . . . . 0.0 110.713 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.904 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.3 mp -67.59 110.96 6.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.107 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.432 ' HD2' ' HE1' ' A' ' 56' ' ' MET . 33.1 Cg_exo -59.65 -156.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.368 2.045 . . . . 0.0 111.998 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.9 m -102.42 -46.19 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 m -57.68 -44.07 85.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.344 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.64 HG11 ' SD ' ' A' ' 56' ' ' MET . 21.9 t -55.92 -60.45 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.408 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TRP . . . . . 0.456 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.55 -30.73 65.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.628 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -72.06 -28.38 63.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.22 -50.29 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 ' O ' ' A' ' 71' ' ' ILE . 17.9 tt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.89 0.376 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -87.92 -31.58 19.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.968 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.5 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 1.0 OUTLIER -138.82 149.05 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.863 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 13.5 mttm -46.3 -57.86 7.66 Favored Pre-proline 0 N--CA 1.462 0.167 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.751 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.693 ' C ' HD12 ' A' ' 6' ' ' LEU . 35.5 Cg_endo -63.97 -1.35 3.44 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.69 2.26 . . . . 0.0 112.626 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.693 HD12 ' C ' ' A' ' 5' ' ' PRO . 2.1 mp 76.2 -167.85 0.07 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.859 0.361 . . . . 0.0 110.915 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.23 163.34 12.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.805 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.593 ' HA ' HG13 ' A' ' 42' ' ' VAL . 14.5 mttt -54.05 -27.19 30.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.037 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.2 t -78.19 -35.05 49.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.404 ' CB ' ' HB3' ' A' ' 6' ' ' LEU . 1.5 m-20 -59.84 -50.41 73.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.841 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.738 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.3 m-85 -74.45 -43.73 54.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 110.406 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.528 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 58.0 tp -56.06 -43.7 78.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.812 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.68 93.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.713 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 -24.39 58.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.085 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 24' ' ' LEU . 1.2 mt -66.72 -45.79 77.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.142 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -68.12 -17.95 64.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.243 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -56.26 -22.45 30.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.245 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.8 p -50.74 176.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.485 ' HG3' HG22 ' A' ' 20' ' ' THR . 8.2 pt20 -102.4 -34.05 9.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.988 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.487 HG23 ' H ' ' A' ' 23' ' ' THR . 4.4 t -153.03 164.6 37.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.767 HG13 HD21 ' A' ' 54' ' ' LEU . 43.7 mm -74.5 -41.58 49.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.425 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.23 -48.24 71.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.173 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.487 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -78.08 -40.88 37.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.22 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.952 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.4 tm? -60.33 -38.04 82.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.14 -39.12 77.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.073 0.463 . . . . 0.0 110.528 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -59.06 -37.13 76.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.87 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.952 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.4 p -74.26 -26.44 20.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.645 HG23 ' HE1' ' A' ' 43' ' ' PHE . 23.4 mt -60.42 -38.72 78.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.108 0.48 . . . . 0.0 110.234 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -70.53 -46.2 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.693 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -47.54 73.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' HD22 ' A' ' 35' ' ' LEU . 1.8 t-20 -62.12 -34.11 75.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -41.29 88.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -90.9 -21.79 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -59.63 -72.62 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.132 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.3 -156.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.158 0.504 . . . . 0.0 111.421 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 m -118.66 -178.21 3.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.242 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.91 -25.22 64.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -73.19 -48.06 38.39 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.767 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -79.58 -29.72 41.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.242 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.821 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.5 tt -61.35 -36.22 79.59 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.028 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.86 -37.41 68.73 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.738 HG12 ' HB2' ' A' ' 11' ' ' TYR . 12.5 t -77.04 -30.69 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.581 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.645 ' HE1' HG23 ' A' ' 28' ' ' ILE . 25.2 t80 -75.89 -37.98 58.27 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.829 0.347 . . . . 0.0 111.249 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.81 -48.11 48.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 96.8 p -62.11 -33.11 73.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -76.21 -37.72 57.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.173 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.94 -28.23 69.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.219 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -75.03 -46.27 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.052 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -42.25 71.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 109.84 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -48.11 73.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.329 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.876 HD21 HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -57.93 -37.03 73.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.919 179.314 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.961 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -61.1 -51.1 70.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.424 ' HB3' ' HB3' ' A' ' 60' ' ' TYR . 7.7 pt-20 -64.4 -29.6 70.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.624 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.767 HD21 HG13 ' A' ' 21' ' ' ILE . 1.7 mp -59.91 -35.29 74.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.917 0.389 . . . . 0.0 110.25 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.817 ' OG1' HD13 ' A' ' 71' ' ' ILE . 74.4 m -82.11 -34.81 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.475 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.649 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.4 tpp -96.52 20.08 11.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 1.4 m-20 77.45 -72.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.173 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER -151.23 34.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.666 0.269 . . . . 0.0 111.211 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.625 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.4 tm? -117.22 117.99 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 0.0 111.47 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.484 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.1 p90 -134.93 161.13 36.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.674 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 10.3 t0 88.1 -25.27 0.09 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.23 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.12 19.5 14.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.907 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.961 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.2 mp -63.39 119.42 53.11 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.786 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.788 ' HG2' HG23 ' A' ' 67' ' ' VAL . 68.8 Cg_endo -73.88 -167.79 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.448 2.099 . . . . 0.0 112.352 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.0 p -88.72 -26.45 21.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.1 m -71.27 -46.36 61.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.098 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.788 HG23 ' HG2' ' A' ' 64' ' ' PRO . 41.4 t -63.64 -48.64 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -56.51 -27.75 58.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.91 -50.16 15.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.264 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.876 HG12 HD21 ' A' ' 51' ' ' LEU . 1.3 tt -94.32 131.3 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.891 0.376 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.867 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.786 0.327 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -123.41 -54.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.416 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 0.3 OUTLIER -133.47 141.14 47.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 2.6 mtpt -58.54 -57.7 24.6 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.419 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 91.0 Cg_endo -82.44 39.19 0.81 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.912 2.408 . . . . 0.0 112.857 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.648 HD13 ' HB3' ' A' ' 10' ' ' ASP . 3.6 mt 58.67 160.82 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.849 0.357 . . . . 0.0 111.265 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.407 HG23 ' HB2' ' A' ' 3' ' ' GLU . 0.8 OUTLIER -111.11 179.52 4.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.948 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.892 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -59.85 -30.0 68.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.066 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.43 -29.38 41.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.648 ' HB3' HD13 ' A' ' 6' ' ' LEU . 16.9 m-20 -63.16 -50.33 70.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.084 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.785 ' HB2' HG12 ' A' ' 42' ' ' VAL . 5.2 m-85 -73.83 -43.16 59.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.838 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.765 HD11 ' CD2' ' A' ' 49' ' ' HIS . 1.5 tp -55.35 -41.48 72.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.987 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.411 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.39 -42.49 59.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.078 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.04 -39.14 89.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.99 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.536 HD13 ' CB ' ' A' ' 46' ' ' ALA . 0.5 OUTLIER -59.49 -44.7 93.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -74.85 -25.54 59.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.969 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -56.68 -22.46 35.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.288 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.4 173.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.775 0.322 . . . . 0.0 111.145 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -101.38 -38.08 8.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.183 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 23' ' ' THR . 13.3 t -140.85 159.96 41.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.1 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.602 ' CD1' HD11 ' A' ' 54' ' ' LEU . 47.3 mm -74.49 -37.76 44.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.345 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -53.98 -50.94 65.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.642 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -72.96 -30.37 63.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.905 0.383 . . . . 0.0 110.514 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.962 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -70.26 -39.13 75.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.663 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -58.03 -39.31 78.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.102 0.477 . . . . 0.0 110.533 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -35.03 71.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.728 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.962 HG12 ' O ' ' A' ' 24' ' ' LEU . 5.8 p -77.47 -26.41 15.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.093 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.463 HD11 ' CD1' ' A' ' 24' ' ' LEU . 35.9 mt -59.18 -39.01 77.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.977 0.417 . . . . 0.0 110.42 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.54 -43.53 55.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.821 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 mmtp -65.69 -47.6 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.454 ' CB ' ' CE2' ' A' ' 43' ' ' PHE . 2.6 m120 -68.38 -31.7 71.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.084 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.72 -36.16 78.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.084 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.35 -22.01 16.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER -57.55 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.227 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.777 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.93 -156.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.229 0.538 . . . . 0.0 111.553 -179.75 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.496 ' N ' HD23 ' A' ' 35' ' ' LEU . 6.8 m -118.67 -178.24 3.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.128 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -59.55 -25.01 64.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.88 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -73.15 -48.32 36.51 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.718 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -79.7 -30.31 40.98 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.412 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.767 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.2 tt -57.99 -35.03 70.63 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.834 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -30.88 62.14 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.892 HG13 ' HA ' ' A' ' 8' ' ' LYS . 47.0 t -76.78 -33.4 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.23 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 31' ' ' ASN . 9.9 t80 -75.87 -43.25 46.46 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.955 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -42.29 98.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.831 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.5 p -58.38 -46.0 87.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.813 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.536 ' CB ' HD13 ' A' ' 15' ' ' LEU . . . -59.75 -29.69 68.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.998 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.09 -47.19 85.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.58 -48.67 76.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.765 ' CD2' HD11 ' A' ' 12' ' ' LEU . 28.9 t60 -60.02 -45.38 92.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -64.75 -48.13 75.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.661 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -30.67 69.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.696 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' A' ' 59' ' ' LEU . . . -61.46 -51.58 68.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.315 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.533 ' N ' ' HB2' ' A' ' 59' ' ' LEU . 2.1 tm-20 -64.4 -26.88 68.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.66 -179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.602 HD11 ' CD1' ' A' ' 21' ' ' ILE . 5.0 mt -78.36 -36.58 45.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.956 HG21 HG22 ' A' ' 71' ' ' ILE . 9.8 m -82.97 -43.4 16.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.894 ' HB3' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.61 3.49 16.71 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.431 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 53' ' ' GLU . 2.1 t30 63.88 126.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.815 0.34 . . . . 0.0 110.581 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 0.4 OUTLIER 49.47 86.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.02 0.438 . . . . 0.0 110.805 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.894 HD21 ' HB3' ' A' ' 56' ' ' MET . 4.1 mm? -119.79 148.62 43.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.666 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.546 ' O ' ' CD1' ' A' ' 63' ' ' ILE . 31.1 m-85 -83.07 161.08 21.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.913 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -61.56 -17.07 53.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.446 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.71 78.43 1.85 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.806 0.336 . . . . 0.0 111.572 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.73 ' CG1' HD12 ' A' ' 59' ' ' LEU . 1.3 mp -68.41 136.05 90.96 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.651 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.27 -157.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.473 2.115 . . . . 0.0 112.208 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 t -99.44 -34.11 10.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.2 m -59.99 -46.18 90.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.56 ' HB ' HG23 ' A' ' 63' ' ' ILE . 21.7 t -61.37 -45.55 98.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.042 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.697 ' CE3' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.8 -23.63 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.148 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -28.59 62.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.034 179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -76.39 -50.32 14.5 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.805 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.956 HG22 HG21 ' A' ' 55' ' ' THR . 7.4 pt -42.58 125.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.762 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.857 -179.974 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.844 0.354 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 m -103.3 99.47 9.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.874 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -136.29 -176.6 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.903 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 0.7 OUTLIER -52.79 -61.61 4.48 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.68 ' C ' HD22 ' A' ' 6' ' ' LEU . 25.4 Cg_endo -62.1 -166.8 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.401 2.067 . . . . 0.0 112.131 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.68 HD22 ' C ' ' A' ' 5' ' ' PRO . 2.8 mm? -117.18 119.58 35.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -86.54 179.51 6.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.968 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.907 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.8 -34.5 71.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.41 -30.04 42.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.055 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.582 ' HB3' HD12 ' A' ' 6' ' ' LEU . 4.2 m-20 -61.92 -50.35 72.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.608 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.8 m-30 -68.18 -51.95 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' HB1' ' A' ' 46' ' ' ALA . 1.2 tt -55.37 -45.04 76.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.047 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -45.32 71.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.919 0.39 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -29.52 70.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.905 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.555 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -63.15 -45.96 89.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.053 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -67.86 -16.87 64.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.274 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -53.95 -24.66 17.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.43 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.74 168.76 4.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.876 0.369 . . . . 0.0 111.105 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -41.76 6.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.951 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.605 HG23 ' H ' ' A' ' 23' ' ' THR . 12.8 t -129.16 150.72 50.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.783 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' NH2' ' A' ' 50' ' ' ARG . 39.0 mm -67.56 -39.61 82.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.767 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.99 -51.03 65.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.665 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.605 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -74.61 -29.42 61.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.436 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.737 HD23 ' O ' ' A' ' 24' ' ' LEU . 3.0 tt -69.76 -38.66 76.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.587 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.48 -30.15 64.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.041 0.448 . . . . 0.0 110.456 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -60.26 -33.09 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -77.06 -31.36 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.079 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.402 ' CD1' ' CD2' ' A' ' 24' ' ' LEU . 1.7 mp -59.15 -33.31 50.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 110.194 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 1.0 OUTLIER -74.78 -49.0 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.949 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -33.08 72.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG22 ' A' ' 27' ' ' VAL . 47.1 m-20 -74.3 -42.46 59.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.26 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -59.85 -30.16 68.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.892 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.429 ' N ' ' HG3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -98.72 -5.74 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.409 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -70.16 0.52 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.797 0.332 . . . . 0.0 111.232 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.962 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.26 -160.42 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.285 0.564 . . . . 0.0 111.97 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -119.17 -178.03 3.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.164 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.65 -25.29 66.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.378 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -72.36 -47.49 49.17 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.733 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.962 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.9 tp10 -78.79 -29.67 45.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.928 0.394 . . . . 0.0 110.201 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HA ' HD11 ' A' ' 35' ' ' LEU . 1.1 tt -57.17 -31.21 65.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.715 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.02 -32.4 63.96 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.907 HG13 ' HA ' ' A' ' 8' ' ' LYS . 72.4 t -76.84 -32.79 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.042 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -75.94 -42.63 48.13 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.868 0.366 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.48 -48.13 68.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.1 t -58.87 -46.52 87.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.853 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.55 ' HB1' ' HG ' ' A' ' 12' ' ' LEU . . . -71.02 -28.57 64.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.149 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.406 ' O ' HD23 ' A' ' 51' ' ' LEU . . . -61.31 -66.34 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.334 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -54.94 -43.66 73.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.183 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -51.6 67.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.837 0.351 . . . . 0.0 110.459 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.413 ' NH2' ' CD1' ' A' ' 21' ' ' ILE . 0.7 OUTLIER -61.24 -40.75 95.21 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.119 0.485 . . . . 0.0 109.955 179.161 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -66.71 -34.8 78.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.159 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.937 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -65.34 -51.04 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.15 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.431 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.7 pt-20 -56.93 -41.89 79.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.859 0.361 . . . . 0.0 110.465 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.12 -29.04 65.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.205 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.412 HG21 HG12 ' A' ' 67' ' ' VAL . 2.7 m -82.34 -36.01 27.29 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.092 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.763 ' SD ' HG11 ' A' ' 67' ' ' VAL . 11.4 mmm -93.12 17.96 10.09 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 m120 64.38 62.71 0.8 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.962 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? 64.71 27.23 13.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.977 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.802 HD22 ' N ' ' A' ' 60' ' ' TYR . 1.0 OUTLIER -119.96 121.51 39.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.94 0.4 . . . . 0.0 111.372 179.455 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.802 ' N ' HD22 ' A' ' 59' ' ' LEU . 4.4 p90 -126.35 161.47 27.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.563 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 1.1 t70 87.7 -7.75 0.59 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.027 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.649 ' HB2' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -128.6 13.62 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.704 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.937 HG12 ' HB1' ' A' ' 52' ' ' ALA . 1.8 mp -65.2 118.2 47.44 Favored Pre-proline 0 C--N 1.333 -0.127 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.903 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.692 ' HG2' HG23 ' A' ' 67' ' ' VAL . 61.9 Cg_endo -73.25 -168.17 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.407 2.071 . . . . 0.0 112.22 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -92.34 -28.61 16.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.6 m -68.39 -46.2 70.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.763 HG11 ' SD ' ' A' ' 56' ' ' MET . 23.3 t -69.19 -49.43 61.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.105 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.71 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -57.65 -40.58 79.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -63.03 -30.89 71.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.779 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -70.9 -50.18 37.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.446 HG23 ' CE3' ' A' ' 68' ' ' TRP . 2.4 tt -91.66 125.16 44.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.064 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.784 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.744 ' O ' HD23 ' A' ' 6' ' ' LEU . 4.6 mtt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.655 0.264 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.4 p -66.55 109.99 3.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.988 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -166.25 -175.16 3.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.796 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 18.3 mtmt -52.93 -62.38 3.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.819 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 98.1 Cg_endo -78.56 57.42 6.31 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.543 2.162 . . . . 0.0 112.176 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.744 HD23 ' O ' ' A' ' 1' ' ' MET . 2.4 tm? -105.08 -79.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.988 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.606 HG23 HD13 ' A' ' 6' ' ' LEU . 9.2 p -147.72 170.74 16.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.832 0.348 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HA ' HG13 ' A' ' 42' ' ' VAL . 28.1 mttt -59.14 -38.88 80.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.742 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -42.79 85.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.003 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.1 -50.37 69.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.007 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.417 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -76.6 -44.26 35.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.971 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.692 HD23 ' O ' ' A' ' 46' ' ' ALA . 2.9 tm? -55.38 -47.32 76.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.293 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -69.72 -31.17 69.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.777 0.323 . . . . 0.0 110.935 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -77.9 -29.69 50.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.023 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.967 HD23 HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -66.28 -45.81 79.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.077 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -18.03 63.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -23.65 19.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.26 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -173.1 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -102.29 -39.93 6.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 23' ' ' THR . 13.6 t -139.2 150.64 45.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.101 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 21' ' ' ILE . 3.3 mp -74.63 -32.49 29.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.864 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -55.87 -50.96 69.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.641 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -63.47 -45.46 90.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.494 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.967 HD13 HD23 ' A' ' 15' ' ' LEU . 1.9 mt -56.04 -31.49 63.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -39.85 79.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.091 0.472 . . . . 0.0 109.823 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -48.18 77.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.23 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.796 ' CG1' HD23 ' A' ' 24' ' ' LEU . 3.8 p -71.75 -23.85 22.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.5 HD12 ' CZ ' ' A' ' 43' ' ' PHE . 1.1 tp -59.16 -38.48 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.337 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -43.51 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.691 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -64.64 -47.45 78.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 1.1 t-20 -59.01 -34.61 72.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.903 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.41 ' O ' HD12 ' A' ' 40' ' ' LEU . 12.3 mtpt -58.63 -47.22 85.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.656 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -88.54 -7.09 57.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.123 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -74.55 -67.62 0.61 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.128 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.782 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.23 -155.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.193 0.521 . . . . 0.0 111.388 -179.804 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 35' ' ' LEU . 22.9 t -118.56 -178.25 3.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.168 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.0 -25.08 64.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.837 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -72.76 -48.26 39.88 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.734 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -79.79 -29.83 40.47 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.513 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.782 ' HB2' HD21 ' A' ' 35' ' ' LEU . 8.2 tt -58.93 -36.72 75.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.874 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.52 66.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.549 HG13 ' HA ' ' A' ' 8' ' ' LYS . 8.0 t -76.95 -30.69 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.295 178.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.5 ' CZ ' HD12 ' A' ' 28' ' ' ILE . 7.3 t80 -75.81 -42.37 50.13 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.086 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -65.96 -48.01 72.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.944 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.5 p -67.79 -46.26 72.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.996 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -65.86 -34.93 79.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.63 -24.47 58.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.403 ' OD2' ' CZ2' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -73.64 -50.82 19.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.055 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.48 -51.8 65.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.069 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.624 ' CD ' HD22 ' A' ' 15' ' ' LEU . 5.0 ptm85 -54.75 -40.73 69.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.208 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -47.88 35.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.872 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.704 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.62 -49.38 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.413 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -64.73 -29.44 70.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.171 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -65.8 -28.91 69.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.129 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.9 m -80.11 -39.01 30.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.491 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.601 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.7 tpp -99.67 4.67 45.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.783 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.8 t30 77.27 91.79 0.07 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.971 0.415 . . . . 0.0 111.79 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.6 OUTLIER 40.34 48.97 2.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.468 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.575 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 2.5 tm? -119.96 118.07 29.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.695 0.284 . . . . 0.0 111.142 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.553 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.1 OUTLIER -132.79 160.48 36.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 110.979 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.0 t0 74.92 4.95 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.888 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.25 7.44 1.02 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.704 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.7 mp -63.34 110.61 3.8 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.43 -178.44 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.519 2.146 . . . . 0.0 112.245 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.82 -46.45 14.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.73 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -46.2 69.76 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.067 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.601 HG21 ' CE ' ' A' ' 56' ' ' MET . 21.9 t -59.65 -55.12 25.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.469 ' CE3' HG23 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.86 -44.42 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.588 179.667 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -32.98 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.003 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -70.06 -50.22 43.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 71' ' ' ILE . 14.2 tt -93.3 119.04 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.207 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -67.39 81.08 0.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -178.76 -98.93 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.553 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.846 ' HB2' HG23 ' A' ' 7' ' ' THR . 0.1 OUTLIER 52.85 174.98 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.179 0 CA-C-O 120.607 0.241 . . . . 0.0 110.926 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.462 ' CD ' ' HB3' ' A' ' 4' ' ' LYS . 24.6 Cg_exo -63.19 72.62 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.511 2.141 . . . . 0.0 112.183 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.471 ' N ' HD22 ' A' ' 6' ' ' LEU . 3.6 mm? 61.45 83.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.14 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.846 HG23 ' HB2' ' A' ' 4' ' ' LYS . 1.1 p -84.63 179.63 7.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.872 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.851 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -51.75 -32.42 30.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.174 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.31 -35.89 40.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.03 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.1 -50.36 74.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.14 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.489 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -69.69 -52.03 29.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.825 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.597 HD23 ' O ' ' A' ' 12' ' ' LEU . 5.2 tt -56.0 -40.59 73.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -42.92 84.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.5 mtt180 -76.28 -27.81 56.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -59.36 -42.73 92.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -69.19 -22.23 63.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -56.06 -22.65 28.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.287 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.818 ' SG ' HD12 ' A' ' 24' ' ' LEU . 31.0 p -49.63 172.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.28 -35.22 8.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.611 HG23 ' H ' ' A' ' 23' ' ' THR . 14.9 t -150.01 159.7 44.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.88 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 54' ' ' LEU . 41.1 mm -74.44 -39.34 48.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.596 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.9 -50.94 65.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.611 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -70.68 -29.02 65.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.661 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.884 ' O ' HG12 ' A' ' 27' ' ' VAL . 5.2 tt -74.66 -36.07 62.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -57.48 -32.47 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 0.0 110.195 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -64.5 -33.8 76.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.197 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.884 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.1 p -80.98 -26.8 10.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.204 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 24' ' ' LEU . 29.5 mt -59.01 -40.27 80.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.978 0.418 . . . . 0.0 110.313 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -74.73 -41.73 59.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.838 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -68.61 -47.68 66.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.243 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.464 ' HB2' ' CE2' ' A' ' 43' ' ' PHE . 2.3 m120 -66.08 -31.65 72.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.61 -48.1 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.139 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.16 -2.38 58.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.783 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 3.2 mt-10 -79.36 -77.86 0.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.759 0.314 . . . . 0.0 110.952 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.969 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.78 -157.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.204 0.526 . . . . 0.0 111.577 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.2 m -118.76 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.306 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -60.69 -25.4 66.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.536 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -73.67 -47.52 39.1 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.816 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.969 ' CG ' HD12 ' A' ' 35' ' ' LEU . 2.7 tp10 -78.86 -34.99 44.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.993 0.425 . . . . 0.0 110.15 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.71 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.8 tt -57.99 -34.73 70.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.332 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -34.53 65.27 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 8' ' ' LYS . 65.0 t -76.96 -33.29 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.337 178.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 31' ' ' ASN . 8.9 t80 -76.1 -48.07 22.12 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.436 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.65 -48.3 81.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.5 p -67.96 -37.17 81.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.652 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.18 -40.16 46.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.789 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.28 -34.71 59.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.855 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.45 ' HB3' ' CH2' ' A' ' 68' ' ' TRP . 10.6 m-20 -72.0 -50.69 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.56 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.85 -45.14 74.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.129 0.49 . . . . 0.0 110.019 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -64.16 -47.86 78.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.681 0.753 . . . . 0.0 109.588 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.895 ' O ' HD22 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -60.89 -33.8 73.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.662 -1.153 . . . . 0.0 110.341 179.714 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.957 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -63.83 -51.32 65.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.099 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.419 ' O ' ' N ' ' A' ' 58' ' ' LYS . 5.0 pt-20 -57.34 -41.89 80.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.738 0.304 . . . . 0.0 110.767 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.434 HD11 HD11 ' A' ' 21' ' ' ILE . 2.8 mt -58.69 -31.78 68.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.921 0.391 . . . . 0.0 110.623 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.62 -33.19 27.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.951 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.804 ' HG2' HD12 ' A' ' 59' ' ' LEU . 9.9 tpp -95.99 15.93 19.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.496 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 65.87 68.86 0.46 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.045 0.45 . . . . 0.0 111.168 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 55.91 28.79 13.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.673 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.804 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.2 tm? -119.83 118.57 31.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.893 0.377 . . . . 0.0 111.485 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -128.57 161.23 30.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.666 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.499 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 13.8 t0 89.72 -12.41 0.35 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.692 ' HB3' HD11 ' A' ' 59' ' ' LEU . 3.8 tmmt? -131.24 20.48 4.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.734 0.302 . . . . 0.0 110.801 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.957 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.9 mp -62.21 110.69 3.53 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.034 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.485 ' HB2' HG23 ' A' ' 67' ' ' VAL . 52.0 Cg_exo -55.23 166.02 2.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.47 2.114 . . . . 0.0 112.263 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.8 m -74.92 -40.26 60.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.931 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -43.74 98.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.929 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.72 HG11 ' CE ' ' A' ' 56' ' ' MET . 14.5 t -65.71 -51.29 63.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.729 ' CH2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -57.67 -42.33 83.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -60.61 -30.57 69.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.731 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -75.96 -50.29 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.807 ' CD1' HD21 ' A' ' 51' ' ' LEU . 1.5 tt -92.59 124.38 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.183 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.883 -179.977 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.86 0.362 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.92 15.99 5.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 64.39 -102.88 0.1 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.616 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.489 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 2.7 mttm 54.89 173.25 0.04 OUTLIER Pre-proline 0 CA--C 1.529 0.142 0 O-C-N 122.354 -0.216 . . . . 0.0 110.519 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.489 ' HD2' ' CB ' ' A' ' 4' ' ' LYS . 23.1 Cg_endo -61.89 75.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.083 1.855 . . . . 0.0 111.835 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.613 ' N ' HD22 ' A' ' 6' ' ' LEU . 2.6 mm? 63.89 88.92 0.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.029 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.414 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -83.84 178.79 7.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.868 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.9 OUTLIER -51.69 -37.54 51.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 -179.649 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.66 -29.23 40.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.414 ' HB2' ' N ' ' A' ' 7' ' ' THR . 3.3 m-20 -55.07 -50.79 68.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.654 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.707 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -76.75 -36.91 56.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.683 0.278 . . . . 0.0 111.065 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 8' ' ' LYS . 13.7 mt -55.14 -47.5 75.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.131 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 34.7 mtm -76.92 -41.8 41.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -60.58 -37.06 80.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.807 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.54 HD22 ' HD2' ' A' ' 50' ' ' ARG . 1.7 tt -64.28 -45.77 86.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.81 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -71.86 -22.61 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.964 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.62 -27.11 57.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.215 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 167.57 0.46 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -96.59 -41.4 8.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.119 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.618 HG23 ' H ' ' A' ' 23' ' ' THR . 9.9 t -131.43 160.81 34.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.408 HG13 HD21 ' A' ' 54' ' ' LEU . 44.6 mm -74.51 -41.15 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.294 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.2 -50.89 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.032 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.618 ' H ' HG23 ' A' ' 20' ' ' THR . 0.7 OUTLIER -64.85 -44.52 89.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.009 0.433 . . . . 0.0 110.454 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.935 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -58.38 -38.79 78.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -57.96 -38.11 75.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.087 0.47 . . . . 0.0 110.549 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -59.06 -38.84 80.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.635 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.935 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.3 p -72.97 -26.01 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.538 HG23 ' HE1' ' A' ' 43' ' ' PHE . 22.7 mt -61.63 -38.17 79.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.952 0.406 . . . . 0.0 110.481 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 6.0 tt0 -74.14 -36.41 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -36.11 60.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.854 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.567 ' O ' HD22 ' A' ' 35' ' ' LEU . 2.4 m120 -78.55 -42.56 28.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.325 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HA ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.57 -36.16 73.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.019 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -87.93 -19.87 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -68.42 -78.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.23 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.94 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.38 -158.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.214 0.53 . . . . 0.0 111.559 -179.687 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -178.11 3.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.325 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.35 -25.39 65.8 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.588 179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -74.16 -47.45 35.75 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.894 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.94 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -78.94 -33.92 44.94 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.005 0.431 . . . . 0.0 110.071 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.685 ' HA ' HD11 ' A' ' 35' ' ' LEU . 7.5 tt -58.33 -32.97 68.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -30.57 61.8 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.868 HG13 ' HA ' ' A' ' 8' ' ' LYS . 89.0 t -76.84 -34.43 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.171 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HE1' HG23 ' A' ' 28' ' ' ILE . 13.1 t80 -75.98 -47.96 22.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.965 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.44 -42.61 87.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 39.8 m -60.01 -42.63 94.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.957 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -74.73 -30.64 61.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.309 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.07 -50.42 19.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.227 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.76 -48.05 80.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.01 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.5 m170 -56.05 -39.48 72.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.993 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.54 ' HD2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -70.52 -39.51 74.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.89 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.28 60.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.778 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.909 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.8 -51.18 70.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.245 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.802 ' HA ' HD23 ' A' ' 59' ' ' LEU . 24.6 pt-20 -61.94 -42.12 98.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.047 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -61.95 -28.67 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.9 m -65.17 -42.92 93.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.636 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.865 ' HB3' HD22 ' A' ' 59' ' ' LEU . 32.2 ttm -99.61 -30.76 11.94 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.612 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' MET . 4.5 m-20 156.94 -74.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.244 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -153.0 32.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.5 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.865 HD22 ' HB3' ' A' ' 56' ' ' MET . 0.2 OUTLIER -88.57 139.74 30.17 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.591 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.739 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -135.04 154.18 51.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.832 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.79 -62.09 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -56.96 -5.53 0.25 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.32 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.909 HG12 ' HB1' ' A' ' 52' ' ' ALA . 5.3 mp -60.94 110.26 2.82 Favored Pre-proline 0 C--N 1.33 -0.274 0 C-N-CA 121.167 -0.213 . . . . 0.0 110.712 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -66.65 -158.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.637 2.225 . . . . 0.0 112.067 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -98.2 -25.03 15.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.829 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.466 ' HA ' ' HG2' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -69.86 -46.15 66.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.969 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.86 -40.22 80.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.679 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -65.63 -39.1 91.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.964 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.466 ' HG2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -66.27 -27.27 67.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.014 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.417 ' N ' ' HG3' ' A' ' 69' ' ' LYS . 12.3 t80 -66.31 -50.22 64.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 tt -87.09 144.24 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.865 179.959 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 tpt . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.92 0.39 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.7 m -150.05 -73.44 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.76 ' CB ' HG23 ' A' ' 7' ' ' THR . 1.2 tt0 -147.17 142.25 27.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.81 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -58.31 17.83 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.117 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -77.6 44.8 1.6 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.731 2.288 . . . . 0.0 113.239 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.616 ' N ' HD22 ' A' ' 6' ' ' LEU . 2.4 mm? 59.63 148.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.081 0.467 . . . . 0.0 111.626 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.76 HG23 ' CB ' ' A' ' 3' ' ' GLU . 0.1 OUTLIER -120.63 179.5 4.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.965 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -53.82 -31.71 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.228 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -36.09 55.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.476 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 6.2 m-20 -54.83 -50.32 68.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.383 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.686 ' HB2' HG12 ' A' ' 42' ' ' VAL . 8.1 m-85 -74.84 -38.38 62.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.87 0.367 . . . . 0.0 110.91 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.586 HD13 ' C ' ' A' ' 12' ' ' LEU . 2.3 tm? -55.5 -47.44 76.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.43 ' HE3' ' HB2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.19 -32.64 63.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 0.0 111.08 -179.841 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 1.4 ttt180 -74.02 -23.91 59.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.923 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.806 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -72.94 -45.74 56.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.938 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -64.01 -17.17 63.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.499 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -54.05 -26.6 27.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.754 0.312 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.66 165.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.826 0.346 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -78.03 -40.68 38.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 23' ' ' THR . 14.2 t -149.93 165.74 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.651 HG12 HD21 ' A' ' 54' ' ' LEU . 2.0 mp -74.52 -29.93 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.39 -50.5 67.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.93 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.432 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -75.99 -32.51 59.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.198 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.896 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.68 -36.18 81.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.444 179.622 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 28' ' ' ILE . 3.9 tp10 -57.15 -31.82 65.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.234 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -65.15 -34.95 79.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.114 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.896 HG12 ' O ' ' A' ' 24' ' ' LEU . 8.6 p -79.84 -27.28 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.07 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 24' ' ' LEU . 39.0 mm -58.14 -39.91 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-O 121.113 0.482 . . . . 0.0 110.233 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -74.18 -43.18 58.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.563 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -64.17 -47.59 79.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.101 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 43' ' ' PHE . 0.7 OUTLIER -66.86 -31.66 72.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.031 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -58.55 -40.34 82.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.952 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -98.99 -0.06 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.507 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -78.91 -68.92 0.61 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.693 0.283 . . . . 0.0 111.216 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.786 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -72.67 -156.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.217 0.532 . . . . 0.0 111.611 -179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.51 ' N ' HD23 ' A' ' 35' ' ' LEU . 32.6 t -118.71 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.098 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 p30 -59.65 -25.03 64.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -48.41 39.4 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.719 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.73 -29.92 40.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.962 0.41 . . . . 0.0 110.318 179.556 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.765 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.9 tt -57.41 -32.81 67.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.788 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.01 -35.59 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.965 HG13 ' HA ' ' A' ' 8' ' ' LYS . 57.9 t -76.78 -30.83 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.143 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 31' ' ' ASN . 8.9 t80 -75.83 -41.35 52.84 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.54 -48.18 80.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.5 p -59.95 -35.81 75.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.912 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.49 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -77.23 -29.71 54.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.242 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.23 -52.56 9.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.195 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.74 -44.72 90.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.995 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -58.78 -49.04 79.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.966 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.48 ' HG3' HD22 ' A' ' 15' ' ' LEU . 9.9 mmt180 -61.67 -44.71 96.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -30.71 69.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.896 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.54 -50.98 69.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.222 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.98 -30.68 71.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.856 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 HG12 ' A' ' 21' ' ' ILE . 2.3 mp -60.55 -35.59 76.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.688 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -78.74 -36.3 43.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.986 ' HE1' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -96.92 20.87 10.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 78.48 -63.92 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.859 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -160.5 40.84 0.17 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.077 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.59 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.6 tm? -119.76 117.87 29.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 111.261 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.0 p90 -135.04 161.13 36.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.767 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.482 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 3.1 t0 89.08 -30.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.225 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -112.25 26.56 10.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.765 0.317 . . . . 0.0 110.893 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.986 HG23 ' HE1' ' A' ' 56' ' ' MET . 1.9 mp -72.22 118.24 65.59 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.035 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.781 ' HG2' HG23 ' A' ' 67' ' ' VAL . 74.5 Cg_endo -74.68 -167.61 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.416 2.077 . . . . 0.0 112.294 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -90.57 -26.63 19.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 92.0 p -70.17 -46.18 65.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.781 HG23 ' HG2' ' A' ' 64' ' ' PRO . 42.2 t -63.5 -54.96 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.53 -34.3 68.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.903 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -68.33 -30.32 69.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.87 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -73.95 -49.78 23.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.558 HD13 ' C ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -91.23 118.86 37.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.953 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 71' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.911 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 mtm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.657 ' HA ' HG21 ' A' ' 7' ' ' THR . 18.8 t -115.08 119.59 36.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.933 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -77.72 179.75 6.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 0.6 OUTLIER -59.66 -52.45 73.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.851 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 38.9 Cg_exo -60.53 -159.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.538 2.159 . . . . 0.0 112.028 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.608 ' N ' HD22 ' A' ' 6' ' ' LEU . 2.7 mm? -97.14 115.3 27.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.79 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.657 HG21 ' HA ' ' A' ' 2' ' ' SER . 72.0 p -83.99 177.76 8.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.046 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.862 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.65 -35.17 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.47 -34.64 41.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.05 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.97 -50.5 68.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.174 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.605 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.9 m-85 -76.56 -43.76 37.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.428 . . . . 0.0 110.704 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.619 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.5 tm? -55.93 -47.08 78.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.228 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -31.21 69.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.3 mtt-85 -77.86 -30.35 50.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.809 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -65.87 -45.65 81.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.04 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -64.6 -16.09 62.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.1 ttp85 -54.02 -28.5 38.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.777 0.322 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.65 179.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.872 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -99.22 -36.05 9.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.97 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 23' ' ' THR . 14.6 t -147.02 157.79 43.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.594 ' N ' HD12 ' A' ' 21' ' ' ILE . 1.8 mp -73.77 -29.51 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.793 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.55 -49.9 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.732 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.614 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -76.4 -32.24 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.052 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.921 HD23 ' CG1' ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.18 -35.69 81.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.401 179.571 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.16 -31.84 65.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.234 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -66.21 -37.87 86.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.223 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.921 ' CG1' HD23 ' A' ' 24' ' ' LEU . 9.1 p -75.39 -27.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.611 HG23 ' HE1' ' A' ' 43' ' ' PHE . 35.7 mm -58.8 -42.41 85.43 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.999 0.428 . . . . 0.0 110.107 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -45.55 78.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -46.47 89.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.813 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 3.0 t-20 -75.22 -31.32 60.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.732 ' HD2' HD11 ' A' ' 40' ' ' LEU . 13.7 tptt -58.23 -30.41 66.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -106.26 -6.56 18.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.322 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -73.11 -69.04 0.44 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.645 0.26 . . . . 0.0 111.231 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.6 -156.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 111.527 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.505 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -118.61 -178.16 3.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.191 179.395 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -25.03 64.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.86 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -72.84 -48.33 38.6 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.72 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.83 -29.94 40.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.956 0.408 . . . . 0.0 110.535 179.7 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.804 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.9 tt -58.34 -34.59 70.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.022 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -36.51 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.862 HG13 ' HA ' ' A' ' 8' ' ' LYS . 43.3 t -76.97 -30.98 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.361 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.611 ' HE1' HG23 ' A' ' 28' ' ' ILE . 27.7 t80 -75.85 -48.04 23.1 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.136 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -57.98 -47.51 82.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 89.6 p -59.99 -35.43 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.619 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -67.63 -42.11 82.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.17 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.27 -34.16 42.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.71 -50.77 69.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.25 -44.9 94.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 39.3 tpt85 -60.0 -40.78 90.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.656 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.481 HD23 ' CG2' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -73.94 -39.74 63.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.791 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.9 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -59.27 -50.84 72.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.135 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 2.0 pt-20 -65.36 -27.04 68.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.298 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.32 -28.92 68.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.823 0.344 . . . . 0.0 110.926 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.526 HG21 HG12 ' A' ' 71' ' ' ILE . 59.3 m -82.82 -42.76 17.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.683 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.443 ' HB3' ' CB ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -98.94 5.87 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.388 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 71.8 103.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.941 0.401 . . . . 0.0 111.675 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 1.6 mmpt? 42.37 40.4 1.83 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.497 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.582 ' O ' HD11 ' A' ' 63' ' ' ILE . 1.7 tm? -112.57 121.06 43.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.03 0.443 . . . . 0.0 110.96 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.805 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.45 157.64 40.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.773 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 65.18 -62.87 0.2 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 60' ' ' TYR . 16.4 mttt -53.53 -11.64 0.37 Allowed 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.9 HG12 ' HB1' ' A' ' 52' ' ' ALA . 4.9 mp -60.86 116.88 20.64 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.603 0.24 . . . . 0.0 110.826 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.777 ' HG2' HG23 ' A' ' 67' ' ' VAL . 80.1 Cg_endo -78.19 -167.34 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.551 2.167 . . . . 0.0 112.372 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 -39.87 22.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 95.0 p -59.32 -46.27 89.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.777 HG23 ' HG2' ' A' ' 64' ' ' PRO . 38.8 t -67.83 -43.7 85.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.955 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.596 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -62.77 -33.6 75.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -43.29 98.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.757 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -70.25 -39.7 74.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.811 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.587 HD11 HG12 ' A' ' 67' ' ' VAL . 20.0 mt -72.02 108.38 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.015 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.833 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.401 ' HA ' HG21 ' A' ' 7' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.822 0.344 . . . . 0.0 111.18 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -164.7 -72.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -98.95 157.43 16.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 8.8 mttp -65.66 -62.15 4.84 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.111 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.571 ' C ' HD22 ' A' ' 6' ' ' LEU . 18.6 Cg_endo -57.98 -77.88 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.601 2.201 . . . . 0.0 112.584 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.571 HD22 ' C ' ' A' ' 5' ' ' PRO . 2.9 mm? -125.18 137.94 54.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.873 0.368 . . . . 0.0 111.069 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.401 HG21 ' HA ' ' A' ' 1' ' ' MET . 2.3 p -93.64 177.61 5.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.888 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -63.34 -29.92 71.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.085 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -29.38 42.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.1 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.447 ' CG ' HD12 ' A' ' 6' ' ' LEU . 0.9 OUTLIER -61.79 -50.44 72.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.015 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.564 ' HB2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -76.49 -44.53 34.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.763 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 59.2 tp -55.42 -36.87 66.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.048 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -45.86 67.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.064 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -67.7 -30.99 70.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -45.66 92.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.64 -13.96 61.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.391 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.62 -44.0 69.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.49 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 141.19 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.861 0.362 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -79.89 -36.66 36.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -105.02 147.22 28.06 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 120.838 0.352 . . . . 0.0 110.686 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 40.4 mm -74.43 -45.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.276 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -54.07 -51.0 65.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.949 0.404 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.71 -31.78 58.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.871 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.899 ' O ' HG12 ' A' ' 27' ' ' VAL . 3.4 tm? -83.62 -38.19 21.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.798 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -33.56 68.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.055 0.455 . . . . 0.0 110.384 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -64.46 -35.01 79.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.333 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.899 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.8 p -79.02 -24.67 12.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.931 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 24' ' ' LEU . 25.8 mt -62.07 -38.93 82.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 121.003 0.43 . . . . 0.0 110.439 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -74.72 -43.4 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.147 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -70.41 -36.11 73.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.351 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB3' ' CE2' ' A' ' 43' ' ' PHE . 26.2 t-20 -78.28 -41.61 33.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.624 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.65 -31.91 68.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 110.895 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.439 ' CD2' ' HE2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -92.23 -15.48 27.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -73.57 -71.68 0.3 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.288 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.979 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -62.08 -160.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.078 0.466 . . . . 0.0 111.792 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 t -119.16 -178.19 3.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -59.8 -25.23 64.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.541 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -73.71 -47.49 39.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.795 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.979 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -79.04 -35.45 42.6 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 120.986 0.422 . . . . 0.0 110.14 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.616 ' HA ' HD11 ' A' ' 35' ' ' LEU . 5.6 tt -59.64 -31.16 69.26 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.996 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.03 -36.0 67.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.888 HG13 ' HA ' ' A' ' 8' ' ' LYS . 91.7 t -76.92 -30.76 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.924 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.461 ' CE2' ' HB3' ' A' ' 31' ' ' ASN . 5.9 t80 -74.27 -48.0 31.43 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.4 ' HB2' HD23 ' A' ' 40' ' ' LEU . 2.6 t80 -60.12 -47.99 83.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.137 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -37.02 79.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.988 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.763 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -70.58 -33.82 71.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.53 -37.2 71.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.151 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -45.43 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -58.23 -47.41 83.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.923 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -37.27 83.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.739 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -30.62 62.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.729 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.915 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.78 -51.17 68.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.489 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -30.91 70.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.81 -40.66 89.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.979 0.418 . . . . 0.0 110.483 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.5 HG21 HG12 ' A' ' 71' ' ' ILE . 86.7 m -82.55 -31.51 29.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.59 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.49 ' HG2' HD12 ' A' ' 59' ' ' LEU . 1.3 tpp -95.59 20.91 8.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.074 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.24 -68.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.947 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -159.04 39.43 0.22 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.057 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.0 tm? -119.76 117.85 29.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 111.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.461 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -135.22 161.44 35.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.567 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.9 t70 87.05 -42.41 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.032 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 17.46 13.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.08 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.915 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.5 mp -61.84 110.58 3.33 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.884 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.14 -177.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.391 2.061 . . . . 0.0 112.127 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 95.2 p -89.81 -30.68 17.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.912 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 t -73.57 -42.81 61.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.717 HG12 HD11 ' A' ' 71' ' ' ILE . 24.5 t -57.22 -58.54 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.273 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.461 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.79 -34.14 69.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.803 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -40.24 89.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -75.61 -42.92 50.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.717 HD11 HG12 ' A' ' 67' ' ' VAL . 10.3 mt -66.85 132.1 32.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mtt-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.159 -0.924 . . . . 0.0 110.907 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.783 0.325 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.503 ' HB2' HG21 ' A' ' 7' ' ' THR . 1.6 m -117.74 -39.27 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.026 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.478 ' H ' HG23 ' A' ' 7' ' ' THR . 0.6 OUTLIER -112.62 146.8 37.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.4 ' CB ' ' CD ' ' A' ' 5' ' ' PRO . 1.4 tttp -57.6 -60.52 9.6 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.878 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 4' ' ' LYS . 61.2 Cg_endo -73.1 57.4 3.3 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.517 2.145 . . . . 0.0 112.41 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.42 ' N ' HD22 ' A' ' 6' ' ' LEU . 4.0 mm? 57.48 164.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.206 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.503 HG21 ' HB2' ' A' ' 2' ' ' SER . 0.6 OUTLIER -126.5 169.47 13.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.774 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HA ' HG13 ' A' ' 42' ' ' VAL . 17.0 mttp -64.65 -28.95 69.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.1 t -79.33 -35.49 40.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.061 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.55 -50.31 73.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.949 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.687 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.6 m-85 -76.31 -44.82 35.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.706 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.745 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 12.4 tp -55.43 -40.56 71.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -39.13 69.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.006 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -31.55 62.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.624 HD22 ' HG3' ' A' ' 50' ' ' ARG . 0.3 OUTLIER -60.57 -45.71 92.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.61 60.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.174 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -54.07 -28.81 41.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 m -58.95 159.92 6.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.32 -30.19 11.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.128 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 23' ' ' THR . 13.0 t -126.34 146.78 49.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 111.134 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.604 HG13 HD21 ' A' ' 54' ' ' LEU . 47.5 mm -74.69 -32.91 30.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.134 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.98 -51.02 65.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.364 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.594 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -61.69 -41.77 98.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.893 0.377 . . . . 0.0 110.238 179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.939 HD22 HD11 ' A' ' 28' ' ' ILE . 1.4 mt -59.75 -36.9 77.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.26 70.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.656 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -78.64 -23.15 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.22 0.534 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.72 HG23 ' HA ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -93.23 -23.01 5.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.256 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.939 HD11 HD22 ' A' ' 24' ' ' LEU . 1.8 mm -63.66 -48.19 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 8.3 mt-10 -75.25 -33.37 61.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.03 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -76.48 -47.69 22.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.861 0.362 . . . . 0.0 111.419 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 18.4 t-20 -70.5 -34.81 72.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.29 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -65.63 -36.63 84.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.39 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -1.12 57.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -86.62 -69.87 0.65 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.937 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.71 -157.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.112 0.482 . . . . 0.0 111.558 -179.686 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -118.87 -178.2 3.5 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.214 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -60.73 -25.36 66.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.528 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -47.66 39.05 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.794 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.937 ' CG ' HD12 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -78.89 -32.81 45.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.111 0.482 . . . . 0.0 110.06 179.583 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.8 tt -59.6 -34.82 73.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.056 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -35.39 66.35 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.74 HG13 ' HA ' ' A' ' 8' ' ' LYS . 25.7 t -76.87 -30.52 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.369 178.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.402 ' CG ' ' OD1' ' A' ' 31' ' ' ASN . 12.1 t80 -75.8 -48.0 23.46 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -60.13 -47.52 85.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.013 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -58.7 -46.61 86.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.022 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.745 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -71.6 -29.89 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.182 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.36 -39.93 37.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.305 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -50.7 69.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -61.2 -47.11 87.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.791 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.624 ' HG3' HD22 ' A' ' 15' ' ' LEU . 10.4 mmp_? -60.89 -39.77 90.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.661 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.18 -30.82 62.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.904 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -66.09 -51.19 60.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.346 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -61.96 -34.04 75.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.934 0.397 . . . . 0.0 110.591 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.604 HD21 HG13 ' A' ' 21' ' ' ILE . 1.3 tp -60.93 -42.17 97.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 m -82.6 -27.0 31.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.571 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.892 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.3 tpp -99.07 13.32 33.26 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 63.77 75.89 0.37 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.938 0.399 . . . . 0.0 111.376 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 51.07 31.33 6.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.133 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.892 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.3 tm? -119.75 117.95 29.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.012 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.3 p90 -134.73 161.09 36.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.0 t0 91.12 -24.7 0.07 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -118.68 25.32 10.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.785 0.326 . . . . 0.0 110.713 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.904 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.3 mp -67.59 110.96 6.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.107 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.432 ' HD2' ' HE1' ' A' ' 56' ' ' MET . 33.1 Cg_exo -59.65 -156.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.368 2.045 . . . . 0.0 111.998 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.9 m -102.42 -46.19 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 m -57.68 -44.07 85.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.344 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.64 HG11 ' SD ' ' A' ' 56' ' ' MET . 21.9 t -55.92 -60.45 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.408 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TRP . . . . . 0.456 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.55 -30.73 65.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.628 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -72.06 -28.38 63.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.22 -50.29 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 ' O ' ' A' ' 71' ' ' ILE . 17.9 tt -89.41 107.77 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.111 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.908 -179.966 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.784 0.326 . . . . 0.0 110.805 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.593 ' HA ' HG13 ' A' ' 42' ' ' VAL . 14.5 mttt -54.05 -27.19 30.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.037 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.2 t -78.19 -35.05 49.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.84 -50.41 73.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.841 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.738 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.3 m-85 -74.45 -43.73 54.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 110.406 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.528 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 58.0 tp -56.06 -43.7 78.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.812 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.68 93.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.713 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 -24.39 58.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.085 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 24' ' ' LEU . 1.2 mt -66.72 -45.79 77.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.142 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -68.12 -17.95 64.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.243 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -56.26 -22.45 30.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.245 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.8 p -50.74 176.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.485 ' HG3' HG22 ' A' ' 20' ' ' THR . 8.2 pt20 -102.4 -34.05 9.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.988 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.487 HG23 ' H ' ' A' ' 23' ' ' THR . 4.4 t -153.03 164.6 37.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.767 HG13 HD21 ' A' ' 54' ' ' LEU . 43.7 mm -74.5 -41.58 49.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.425 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.23 -48.24 71.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.173 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.487 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -78.08 -40.88 37.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.22 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.952 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.4 tm? -60.33 -38.04 82.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.14 -39.12 77.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.073 0.463 . . . . 0.0 110.528 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -59.06 -37.13 76.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.87 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.952 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.4 p -74.26 -26.44 20.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.645 HG23 ' HE1' ' A' ' 43' ' ' PHE . 23.4 mt -60.42 -38.72 78.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.108 0.48 . . . . 0.0 110.234 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -70.53 -46.2 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.693 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -47.54 73.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' HD22 ' A' ' 35' ' ' LEU . 1.8 t-20 -62.12 -34.11 75.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -41.29 88.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -90.9 -21.79 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -59.63 -72.62 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.132 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.3 -156.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.158 0.504 . . . . 0.0 111.421 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 m -118.66 -178.21 3.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.242 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.91 -25.22 64.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -73.19 -48.06 38.39 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.767 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -79.58 -29.72 41.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.242 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.821 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.5 tt -61.35 -36.22 79.59 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.028 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.86 -37.41 68.73 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.738 HG12 ' HB2' ' A' ' 11' ' ' TYR . 12.5 t -77.04 -30.69 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.581 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.645 ' HE1' HG23 ' A' ' 28' ' ' ILE . 25.2 t80 -75.89 -37.98 58.27 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.829 0.347 . . . . 0.0 111.249 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.81 -48.11 48.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 96.8 p -62.11 -33.11 73.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -76.21 -37.72 57.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.173 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.94 -28.23 69.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.219 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -75.03 -46.27 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.052 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -42.25 71.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 109.84 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -48.11 73.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.329 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.876 HD21 HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -57.93 -37.03 73.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.919 179.314 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.961 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -61.1 -51.1 70.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.424 ' HB3' ' HB3' ' A' ' 60' ' ' TYR . 7.7 pt-20 -64.4 -29.6 70.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.624 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.767 HD21 HG13 ' A' ' 21' ' ' ILE . 1.7 mp -59.91 -35.29 74.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.917 0.389 . . . . 0.0 110.25 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.817 ' OG1' HD13 ' A' ' 71' ' ' ILE . 74.4 m -82.11 -34.81 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.475 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.649 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.4 tpp -96.52 20.08 11.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 1.4 m-20 77.45 -72.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.173 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER -151.23 34.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.666 0.269 . . . . 0.0 111.211 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.625 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.4 tm? -117.22 117.99 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 0.0 111.47 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.484 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.1 p90 -134.93 161.13 36.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.674 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 10.3 t0 88.1 -25.27 0.09 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.23 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.12 19.5 14.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.907 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.961 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.2 mp -63.39 119.42 53.11 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.786 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.788 ' HG2' HG23 ' A' ' 67' ' ' VAL . 68.8 Cg_endo -73.88 -167.79 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.448 2.099 . . . . 0.0 112.352 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.0 p -88.72 -26.45 21.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.1 m -71.27 -46.36 61.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.098 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.788 HG23 ' HG2' ' A' ' 64' ' ' PRO . 41.4 t -63.64 -48.64 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -56.51 -27.75 58.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.91 -50.16 15.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.264 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.876 HG12 HD21 ' A' ' 51' ' ' LEU . 1.3 tt . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.891 0.376 . . . . 0.0 111.42 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.892 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -59.85 -30.0 68.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.066 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.43 -29.38 41.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.16 -50.33 70.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.084 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.785 ' HB2' HG12 ' A' ' 42' ' ' VAL . 5.2 m-85 -73.83 -43.16 59.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.838 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.765 HD11 ' CD2' ' A' ' 49' ' ' HIS . 1.5 tp -55.35 -41.48 72.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.987 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.411 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.39 -42.49 59.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.078 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.04 -39.14 89.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.99 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.536 HD13 ' CB ' ' A' ' 46' ' ' ALA . 0.5 OUTLIER -59.49 -44.7 93.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -74.85 -25.54 59.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.969 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -56.68 -22.46 35.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.288 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.4 173.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.775 0.322 . . . . 0.0 111.145 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -101.38 -38.08 8.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.183 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 23' ' ' THR . 13.3 t -140.85 159.96 41.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.1 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.602 ' CD1' HD11 ' A' ' 54' ' ' LEU . 47.3 mm -74.49 -37.76 44.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.345 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -53.98 -50.94 65.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.642 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -72.96 -30.37 63.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.905 0.383 . . . . 0.0 110.514 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.962 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -70.26 -39.13 75.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.663 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -58.03 -39.31 78.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.102 0.477 . . . . 0.0 110.533 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -35.03 71.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.728 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.962 HG12 ' O ' ' A' ' 24' ' ' LEU . 5.8 p -77.47 -26.41 15.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.093 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.463 HD11 ' CD1' ' A' ' 24' ' ' LEU . 35.9 mt -59.18 -39.01 77.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.977 0.417 . . . . 0.0 110.42 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.54 -43.53 55.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.821 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 mmtp -65.69 -47.6 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.454 ' CB ' ' CE2' ' A' ' 43' ' ' PHE . 2.6 m120 -68.38 -31.7 71.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.084 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.72 -36.16 78.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.084 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.35 -22.01 16.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER -57.55 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.227 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.777 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.93 -156.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.229 0.538 . . . . 0.0 111.553 -179.75 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.496 ' N ' HD23 ' A' ' 35' ' ' LEU . 6.8 m -118.67 -178.24 3.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.128 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -59.55 -25.01 64.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.88 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -73.15 -48.32 36.51 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.718 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -79.7 -30.31 40.98 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.412 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.767 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.2 tt -57.99 -35.03 70.63 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.834 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -30.88 62.14 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.892 HG13 ' HA ' ' A' ' 8' ' ' LYS . 47.0 t -76.78 -33.4 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.23 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 31' ' ' ASN . 9.9 t80 -75.87 -43.25 46.46 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.955 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -42.29 98.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.831 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.5 p -58.38 -46.0 87.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.813 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.536 ' CB ' HD13 ' A' ' 15' ' ' LEU . . . -59.75 -29.69 68.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.998 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.09 -47.19 85.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.58 -48.67 76.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.765 ' CD2' HD11 ' A' ' 12' ' ' LEU . 28.9 t60 -60.02 -45.38 92.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -64.75 -48.13 75.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.661 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -30.67 69.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.696 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' A' ' 59' ' ' LEU . . . -61.46 -51.58 68.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.315 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.533 ' N ' ' HB2' ' A' ' 59' ' ' LEU . 2.1 tm-20 -64.4 -26.88 68.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.66 -179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.602 HD11 ' CD1' ' A' ' 21' ' ' ILE . 5.0 mt -78.36 -36.58 45.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.956 HG21 HG22 ' A' ' 71' ' ' ILE . 9.8 m -82.97 -43.4 16.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.894 ' HB3' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.61 3.49 16.71 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.431 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 53' ' ' GLU . 2.1 t30 63.88 126.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.815 0.34 . . . . 0.0 110.581 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 0.4 OUTLIER 49.47 86.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.02 0.438 . . . . 0.0 110.805 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.894 HD21 ' HB3' ' A' ' 56' ' ' MET . 4.1 mm? -119.79 148.62 43.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.666 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.546 ' O ' ' CD1' ' A' ' 63' ' ' ILE . 31.1 m-85 -83.07 161.08 21.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.913 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -61.56 -17.07 53.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.446 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.71 78.43 1.85 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.806 0.336 . . . . 0.0 111.572 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.73 ' CG1' HD12 ' A' ' 59' ' ' LEU . 1.3 mp -68.41 136.05 90.96 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.651 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.27 -157.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.473 2.115 . . . . 0.0 112.208 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 t -99.44 -34.11 10.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.2 m -59.99 -46.18 90.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.56 ' HB ' HG23 ' A' ' 63' ' ' ILE . 21.7 t -61.37 -45.55 98.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.042 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.697 ' CE3' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.8 -23.63 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.148 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -28.59 62.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.034 179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -76.39 -50.32 14.5 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.805 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.956 HG22 HG21 ' A' ' 55' ' ' THR . 7.4 pt . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.762 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.902 0.382 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.907 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.8 -34.5 71.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.41 -30.04 42.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.055 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -61.92 -50.35 72.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.187 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.608 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.8 m-30 -68.18 -51.95 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' HB1' ' A' ' 46' ' ' ALA . 1.2 tt -55.37 -45.04 76.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.047 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -45.32 71.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.919 0.39 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -29.52 70.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.905 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.555 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -63.15 -45.96 89.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.053 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -67.86 -16.87 64.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.274 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -53.95 -24.66 17.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.43 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.74 168.76 4.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.876 0.369 . . . . 0.0 111.105 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -41.76 6.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.951 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.605 HG23 ' H ' ' A' ' 23' ' ' THR . 12.8 t -129.16 150.72 50.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.783 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' NH2' ' A' ' 50' ' ' ARG . 39.0 mm -67.56 -39.61 82.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.767 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.99 -51.03 65.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.665 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.605 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -74.61 -29.42 61.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.436 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.737 HD23 ' O ' ' A' ' 24' ' ' LEU . 3.0 tt -69.76 -38.66 76.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.587 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.48 -30.15 64.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.041 0.448 . . . . 0.0 110.456 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -60.26 -33.09 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -77.06 -31.36 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.079 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.402 ' CD1' ' CD2' ' A' ' 24' ' ' LEU . 1.7 mp -59.15 -33.31 50.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 110.194 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 1.0 OUTLIER -74.78 -49.0 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.949 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -33.08 72.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG22 ' A' ' 27' ' ' VAL . 47.1 m-20 -74.3 -42.46 59.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.26 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -59.85 -30.16 68.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.892 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.429 ' N ' ' HG3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -98.72 -5.74 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.409 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -70.16 0.52 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.797 0.332 . . . . 0.0 111.232 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.962 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.26 -160.42 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.285 0.564 . . . . 0.0 111.97 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -119.17 -178.03 3.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.164 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.65 -25.29 66.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.378 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -72.36 -47.49 49.17 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.733 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.962 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.9 tp10 -78.79 -29.67 45.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.928 0.394 . . . . 0.0 110.201 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HA ' HD11 ' A' ' 35' ' ' LEU . 1.1 tt -57.17 -31.21 65.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.715 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.02 -32.4 63.96 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.907 HG13 ' HA ' ' A' ' 8' ' ' LYS . 72.4 t -76.84 -32.79 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.042 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -75.94 -42.63 48.13 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.868 0.366 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.48 -48.13 68.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.1 t -58.87 -46.52 87.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.853 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.55 ' HB1' ' HG ' ' A' ' 12' ' ' LEU . . . -71.02 -28.57 64.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.149 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.406 ' O ' HD23 ' A' ' 51' ' ' LEU . . . -61.31 -66.34 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.334 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -54.94 -43.66 73.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.183 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -51.6 67.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.837 0.351 . . . . 0.0 110.459 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.413 ' NH2' ' CD1' ' A' ' 21' ' ' ILE . 0.7 OUTLIER -61.24 -40.75 95.21 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.119 0.485 . . . . 0.0 109.955 179.161 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -66.71 -34.8 78.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.159 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.937 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -65.34 -51.04 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.15 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.431 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.7 pt-20 -56.93 -41.89 79.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.859 0.361 . . . . 0.0 110.465 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.12 -29.04 65.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.205 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.412 HG21 HG12 ' A' ' 67' ' ' VAL . 2.7 m -82.34 -36.01 27.29 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.092 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.763 ' SD ' HG11 ' A' ' 67' ' ' VAL . 11.4 mmm -93.12 17.96 10.09 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 m120 64.38 62.71 0.8 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.962 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? 64.71 27.23 13.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.977 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.802 HD22 ' N ' ' A' ' 60' ' ' TYR . 1.0 OUTLIER -119.96 121.51 39.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.94 0.4 . . . . 0.0 111.372 179.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.802 ' N ' HD22 ' A' ' 59' ' ' LEU . 4.4 p90 -126.35 161.47 27.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.563 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 1.1 t70 87.7 -7.75 0.59 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.027 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.649 ' HB2' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -128.6 13.62 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.704 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.937 HG12 ' HB1' ' A' ' 52' ' ' ALA . 1.8 mp -65.2 118.2 47.44 Favored Pre-proline 0 C--N 1.333 -0.127 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.903 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.692 ' HG2' HG23 ' A' ' 67' ' ' VAL . 61.9 Cg_endo -73.25 -168.17 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.407 2.071 . . . . 0.0 112.22 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -92.34 -28.61 16.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.6 m -68.39 -46.2 70.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.763 HG11 ' SD ' ' A' ' 56' ' ' MET . 23.3 t -69.19 -49.43 61.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.105 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.71 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -57.65 -40.58 79.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -63.03 -30.89 71.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.779 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -70.9 -50.18 37.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.446 HG23 ' CE3' ' A' ' 68' ' ' TRP . 2.4 tt . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.064 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.832 0.348 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HA ' HG13 ' A' ' 42' ' ' VAL . 28.1 mttt -59.14 -38.88 80.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.742 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -42.79 85.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.003 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.1 -50.37 69.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.007 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.417 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -76.6 -44.26 35.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.971 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.692 HD23 ' O ' ' A' ' 46' ' ' ALA . 2.9 tm? -55.38 -47.32 76.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.293 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -69.72 -31.17 69.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.777 0.323 . . . . 0.0 110.935 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -77.9 -29.69 50.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.023 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.967 HD23 HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -66.28 -45.81 79.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.077 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -18.03 63.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -23.65 19.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.26 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -173.1 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -102.29 -39.93 6.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 23' ' ' THR . 13.6 t -139.2 150.64 45.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.101 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 21' ' ' ILE . 3.3 mp -74.63 -32.49 29.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.864 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -55.87 -50.96 69.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.641 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -63.47 -45.46 90.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.494 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.967 HD13 HD23 ' A' ' 15' ' ' LEU . 1.9 mt -56.04 -31.49 63.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -39.85 79.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.091 0.472 . . . . 0.0 109.823 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -48.18 77.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.23 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.796 ' CG1' HD23 ' A' ' 24' ' ' LEU . 3.8 p -71.75 -23.85 22.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.5 HD12 ' CZ ' ' A' ' 43' ' ' PHE . 1.1 tp -59.16 -38.48 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.337 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -43.51 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.691 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -64.64 -47.45 78.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 1.1 t-20 -59.01 -34.61 72.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.903 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.41 ' O ' HD12 ' A' ' 40' ' ' LEU . 12.3 mtpt -58.63 -47.22 85.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.656 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -88.54 -7.09 57.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.123 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -74.55 -67.62 0.61 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.128 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.782 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.23 -155.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.193 0.521 . . . . 0.0 111.388 -179.804 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 35' ' ' LEU . 22.9 t -118.56 -178.25 3.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.168 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.0 -25.08 64.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.837 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -72.76 -48.26 39.88 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.734 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -79.79 -29.83 40.47 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.513 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.782 ' HB2' HD21 ' A' ' 35' ' ' LEU . 8.2 tt -58.93 -36.72 75.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.874 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.52 66.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.549 HG13 ' HA ' ' A' ' 8' ' ' LYS . 8.0 t -76.95 -30.69 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.295 178.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.5 ' CZ ' HD12 ' A' ' 28' ' ' ILE . 7.3 t80 -75.81 -42.37 50.13 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.086 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -65.96 -48.01 72.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.944 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.5 p -67.79 -46.26 72.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.996 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -65.86 -34.93 79.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.63 -24.47 58.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.403 ' OD2' ' CZ2' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -73.64 -50.82 19.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.055 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.48 -51.8 65.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.069 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.624 ' CD ' HD22 ' A' ' 15' ' ' LEU . 5.0 ptm85 -54.75 -40.73 69.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.208 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -47.88 35.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.872 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.704 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.62 -49.38 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.413 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -64.73 -29.44 70.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.171 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -65.8 -28.91 69.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.129 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.9 m -80.11 -39.01 30.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.491 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.601 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.7 tpp -99.67 4.67 45.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.783 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.8 t30 77.27 91.79 0.07 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.971 0.415 . . . . 0.0 111.79 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.6 OUTLIER 40.34 48.97 2.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.468 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.575 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 2.5 tm? -119.96 118.07 29.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.695 0.284 . . . . 0.0 111.142 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.553 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.1 OUTLIER -132.79 160.48 36.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 110.979 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.0 t0 74.92 4.95 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.888 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.25 7.44 1.02 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.704 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.7 mp -63.34 110.61 3.8 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.43 -178.44 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.519 2.146 . . . . 0.0 112.245 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.82 -46.45 14.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.73 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -46.2 69.76 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.067 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.601 HG21 ' CE ' ' A' ' 56' ' ' MET . 21.9 t -59.65 -55.12 25.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.469 ' CE3' HG23 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.86 -44.42 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.588 179.667 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -32.98 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.003 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -70.06 -50.22 43.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 71' ' ' ILE . 14.2 tt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.207 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.458 -0.035 0 CA-C-O 120.893 0.377 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.851 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -51.75 -32.42 30.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.174 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.31 -35.89 40.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.03 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.1 -50.36 74.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.14 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.489 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -69.69 -52.03 29.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.825 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.597 HD23 ' O ' ' A' ' 12' ' ' LEU . 5.2 tt -56.0 -40.59 73.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -42.92 84.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.5 mtt180 -76.28 -27.81 56.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -59.36 -42.73 92.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -69.19 -22.23 63.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -56.06 -22.65 28.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.287 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.818 ' SG ' HD12 ' A' ' 24' ' ' LEU . 31.0 p -49.63 172.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.28 -35.22 8.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.611 HG23 ' H ' ' A' ' 23' ' ' THR . 14.9 t -150.01 159.7 44.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.88 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 54' ' ' LEU . 41.1 mm -74.44 -39.34 48.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.596 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.9 -50.94 65.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.611 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -70.68 -29.02 65.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.661 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.884 ' O ' HG12 ' A' ' 27' ' ' VAL . 5.2 tt -74.66 -36.07 62.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -57.48 -32.47 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 0.0 110.195 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -64.5 -33.8 76.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.197 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.884 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.1 p -80.98 -26.8 10.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.204 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 24' ' ' LEU . 29.5 mt -59.01 -40.27 80.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.978 0.418 . . . . 0.0 110.313 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -74.73 -41.73 59.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.838 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -68.61 -47.68 66.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.243 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.464 ' HB2' ' CE2' ' A' ' 43' ' ' PHE . 2.3 m120 -66.08 -31.65 72.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.61 -48.1 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.139 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.16 -2.38 58.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.783 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 3.2 mt-10 -79.36 -77.86 0.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.759 0.314 . . . . 0.0 110.952 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.969 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.78 -157.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.204 0.526 . . . . 0.0 111.577 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.2 m -118.76 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.306 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -60.69 -25.4 66.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.536 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -73.67 -47.52 39.1 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.816 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.969 ' CG ' HD12 ' A' ' 35' ' ' LEU . 2.7 tp10 -78.86 -34.99 44.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.993 0.425 . . . . 0.0 110.15 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.71 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.8 tt -57.99 -34.73 70.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.332 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -34.53 65.27 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 8' ' ' LYS . 65.0 t -76.96 -33.29 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.337 178.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 31' ' ' ASN . 8.9 t80 -76.1 -48.07 22.12 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.436 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.65 -48.3 81.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.5 p -67.96 -37.17 81.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.652 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.18 -40.16 46.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.789 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.28 -34.71 59.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.855 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.45 ' HB3' ' CH2' ' A' ' 68' ' ' TRP . 10.6 m-20 -72.0 -50.69 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.56 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.85 -45.14 74.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.129 0.49 . . . . 0.0 110.019 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -64.16 -47.86 78.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.681 0.753 . . . . 0.0 109.588 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.895 ' O ' HD22 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -60.89 -33.8 73.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.662 -1.153 . . . . 0.0 110.341 179.714 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.957 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -63.83 -51.32 65.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.099 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.419 ' O ' ' N ' ' A' ' 58' ' ' LYS . 5.0 pt-20 -57.34 -41.89 80.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.738 0.304 . . . . 0.0 110.767 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.434 HD11 HD11 ' A' ' 21' ' ' ILE . 2.8 mt -58.69 -31.78 68.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.921 0.391 . . . . 0.0 110.623 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.62 -33.19 27.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.951 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.804 ' HG2' HD12 ' A' ' 59' ' ' LEU . 9.9 tpp -95.99 15.93 19.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.496 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 65.87 68.86 0.46 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.045 0.45 . . . . 0.0 111.168 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 55.91 28.79 13.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.673 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.804 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.2 tm? -119.83 118.57 31.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.893 0.377 . . . . 0.0 111.485 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -128.57 161.23 30.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.666 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.499 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 13.8 t0 89.72 -12.41 0.35 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.692 ' HB3' HD11 ' A' ' 59' ' ' LEU . 3.8 tmmt? -131.24 20.48 4.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.734 0.302 . . . . 0.0 110.801 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.957 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.9 mp -62.21 110.69 3.53 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.034 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.485 ' HB2' HG23 ' A' ' 67' ' ' VAL . 52.0 Cg_exo -55.23 166.02 2.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.47 2.114 . . . . 0.0 112.263 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.8 m -74.92 -40.26 60.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.931 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -43.74 98.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.929 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.72 HG11 ' CE ' ' A' ' 56' ' ' MET . 14.5 t -65.71 -51.29 63.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.729 ' CH2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -57.67 -42.33 83.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -60.61 -30.57 69.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.731 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -75.96 -50.29 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.807 ' CD1' HD21 ' A' ' 51' ' ' LEU . 1.5 tt . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.183 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.414 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.85 0.357 . . . . 0.0 110.722 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.868 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.9 OUTLIER -51.69 -37.54 51.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 -179.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.66 -29.23 40.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.414 ' HB2' ' N ' ' A' ' 7' ' ' THR . 3.3 m-20 -55.07 -50.79 68.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.654 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.707 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -76.75 -36.91 56.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.683 0.278 . . . . 0.0 111.065 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 8' ' ' LYS . 13.7 mt -55.14 -47.5 75.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.131 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 34.7 mtm -76.92 -41.8 41.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -60.58 -37.06 80.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.807 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.54 HD22 ' HD2' ' A' ' 50' ' ' ARG . 1.7 tt -64.28 -45.77 86.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.81 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -71.86 -22.61 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.964 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.62 -27.11 57.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.215 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 167.57 0.46 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -96.59 -41.4 8.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.119 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.618 HG23 ' H ' ' A' ' 23' ' ' THR . 9.9 t -131.43 160.81 34.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.408 HG13 HD21 ' A' ' 54' ' ' LEU . 44.6 mm -74.51 -41.15 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.294 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.2 -50.89 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.032 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.618 ' H ' HG23 ' A' ' 20' ' ' THR . 0.7 OUTLIER -64.85 -44.52 89.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.009 0.433 . . . . 0.0 110.454 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.935 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -58.38 -38.79 78.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -57.96 -38.11 75.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.087 0.47 . . . . 0.0 110.549 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -59.06 -38.84 80.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.635 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.935 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.3 p -72.97 -26.01 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.538 HG23 ' HE1' ' A' ' 43' ' ' PHE . 22.7 mt -61.63 -38.17 79.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.952 0.406 . . . . 0.0 110.481 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 6.0 tt0 -74.14 -36.41 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -36.11 60.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.854 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.567 ' O ' HD22 ' A' ' 35' ' ' LEU . 1.2 m-80 -78.55 -42.56 28.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.325 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HA ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.57 -36.16 73.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.019 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -87.93 -19.87 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -68.42 -78.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.23 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.94 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.38 -158.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.214 0.53 . . . . 0.0 111.559 -179.687 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -178.11 3.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.325 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.35 -25.39 65.8 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.588 179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -74.16 -47.45 35.75 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.894 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.94 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -78.94 -33.92 44.94 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.005 0.431 . . . . 0.0 110.071 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.685 ' HA ' HD11 ' A' ' 35' ' ' LEU . 7.5 tt -58.33 -32.97 68.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -30.57 61.8 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.868 HG13 ' HA ' ' A' ' 8' ' ' LYS . 89.0 t -76.84 -34.43 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.171 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HE1' HG23 ' A' ' 28' ' ' ILE . 13.1 t80 -75.98 -47.96 22.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.965 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.44 -42.61 87.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 39.8 m -60.01 -42.63 94.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.957 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -74.73 -30.64 61.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.309 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.07 -50.42 19.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.227 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.76 -48.05 80.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.01 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.5 m170 -56.05 -39.48 72.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.993 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.54 ' HD2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -70.52 -39.51 74.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.89 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.28 60.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.778 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.909 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.8 -51.18 70.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.245 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.802 ' HA ' HD23 ' A' ' 59' ' ' LEU . 24.6 pt-20 -61.94 -42.12 98.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.047 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -61.95 -28.67 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.9 m -65.17 -42.92 93.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.636 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.865 ' HB3' HD22 ' A' ' 59' ' ' LEU . 32.2 ttm -99.61 -30.76 11.94 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.612 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' MET . 4.5 m-20 156.94 -74.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.244 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -153.0 32.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.5 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.865 HD22 ' HB3' ' A' ' 56' ' ' MET . 0.2 OUTLIER -88.57 139.74 30.17 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.591 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.739 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -135.04 154.18 51.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.832 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.79 -62.09 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -56.96 -5.53 0.25 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.32 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.909 HG12 ' HB1' ' A' ' 52' ' ' ALA . 5.3 mp -60.94 110.26 2.82 Favored Pre-proline 0 C--N 1.33 -0.274 0 C-N-CA 121.167 -0.213 . . . . 0.0 110.712 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -66.65 -158.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.637 2.225 . . . . 0.0 112.067 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -98.2 -25.03 15.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.829 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.466 ' HA ' ' HG2' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -69.86 -46.15 66.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.969 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.86 -40.22 80.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.679 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -65.63 -39.1 91.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.964 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.466 ' HG2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -66.27 -27.27 67.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.014 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.417 ' N ' ' HG3' ' A' ' 69' ' ' LYS . 12.3 t80 -66.31 -50.22 64.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 tt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.939 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.824 0.345 . . . . 0.0 110.709 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.965 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -53.82 -31.71 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.228 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -36.09 55.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.476 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 6.2 m-20 -54.83 -50.32 68.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.383 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.686 ' HB2' HG12 ' A' ' 42' ' ' VAL . 8.1 m-85 -74.84 -38.38 62.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.87 0.367 . . . . 0.0 110.91 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.586 HD13 ' C ' ' A' ' 12' ' ' LEU . 2.3 tm? -55.5 -47.44 76.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.43 ' HE3' ' HB2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.19 -32.64 63.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 0.0 111.08 -179.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 1.4 ttt180 -74.02 -23.91 59.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.923 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.806 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -72.94 -45.74 56.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.938 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -64.01 -17.17 63.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.499 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -54.05 -26.6 27.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.754 0.312 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.66 165.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.826 0.346 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -78.03 -40.68 38.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 23' ' ' THR . 14.2 t -149.93 165.74 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.651 HG12 HD21 ' A' ' 54' ' ' LEU . 2.0 mp -74.52 -29.93 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.39 -50.5 67.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.93 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.432 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -75.99 -32.51 59.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.198 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.896 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.68 -36.18 81.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.444 179.622 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 28' ' ' ILE . 3.9 tp10 -57.15 -31.82 65.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.234 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -65.15 -34.95 79.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.114 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.896 HG12 ' O ' ' A' ' 24' ' ' LEU . 8.6 p -79.84 -27.28 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.07 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 24' ' ' LEU . 39.0 mm -58.14 -39.91 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-O 121.113 0.482 . . . . 0.0 110.233 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -74.18 -43.18 58.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.563 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -64.17 -47.59 79.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.101 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 43' ' ' PHE . 0.7 OUTLIER -66.86 -31.66 72.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.031 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -58.55 -40.34 82.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.952 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -98.99 -0.06 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.507 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -78.91 -68.92 0.61 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.693 0.283 . . . . 0.0 111.216 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.786 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -72.67 -156.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.217 0.532 . . . . 0.0 111.611 -179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.51 ' N ' HD23 ' A' ' 35' ' ' LEU . 32.6 t -118.71 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.098 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 p30 -59.65 -25.03 64.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -48.41 39.4 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.719 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.73 -29.92 40.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.962 0.41 . . . . 0.0 110.318 179.556 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.765 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.9 tt -57.41 -32.81 67.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.788 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.01 -35.59 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.965 HG13 ' HA ' ' A' ' 8' ' ' LYS . 57.9 t -76.78 -30.83 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.143 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 31' ' ' ASN . 8.9 t80 -75.83 -41.35 52.84 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.54 -48.18 80.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.5 p -59.95 -35.81 75.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.912 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.49 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -77.23 -29.71 54.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.242 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.23 -52.56 9.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.195 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.74 -44.72 90.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.995 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -58.78 -49.04 79.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.966 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.48 ' HG3' HD22 ' A' ' 15' ' ' LEU . 9.9 mmt180 -61.67 -44.71 96.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -30.71 69.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.896 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.54 -50.98 69.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.222 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.98 -30.68 71.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.856 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 HG12 ' A' ' 21' ' ' ILE . 2.3 mp -60.55 -35.59 76.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.688 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -78.74 -36.3 43.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.986 ' HE1' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -96.92 20.87 10.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 78.48 -63.92 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.859 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -160.5 40.84 0.17 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.077 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.59 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.6 tm? -119.76 117.87 29.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 111.261 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.0 p90 -135.04 161.13 36.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.767 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.482 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 3.1 t0 89.08 -30.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.225 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -112.25 26.56 10.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.765 0.317 . . . . 0.0 110.893 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.986 HG23 ' HE1' ' A' ' 56' ' ' MET . 1.9 mp -72.22 118.24 65.59 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.035 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.781 ' HG2' HG23 ' A' ' 67' ' ' VAL . 74.5 Cg_endo -74.68 -167.61 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.416 2.077 . . . . 0.0 112.294 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -90.57 -26.63 19.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 92.0 p -70.17 -46.18 65.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.781 HG23 ' HG2' ' A' ' 64' ' ' PRO . 42.2 t -63.5 -54.96 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.53 -34.3 68.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.903 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -68.33 -30.32 69.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.87 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -73.95 -49.78 23.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.558 HD13 ' C ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.953 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 72.0 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.782 0.325 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.862 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.65 -35.17 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.47 -34.64 41.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.05 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.97 -50.5 68.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.174 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.605 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.9 m-85 -76.56 -43.76 37.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.428 . . . . 0.0 110.704 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.619 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.5 tm? -55.93 -47.08 78.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.228 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -31.21 69.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.3 mtt-85 -77.86 -30.35 50.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.809 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -65.87 -45.65 81.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.04 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -64.6 -16.09 62.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.1 ttp85 -54.02 -28.5 38.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.777 0.322 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.65 179.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.872 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -99.22 -36.05 9.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.97 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 23' ' ' THR . 14.6 t -147.02 157.79 43.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.594 ' N ' HD12 ' A' ' 21' ' ' ILE . 1.8 mp -73.77 -29.51 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.793 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.55 -49.9 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.732 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.614 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -76.4 -32.24 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.052 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.921 HD23 ' CG1' ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.18 -35.69 81.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.401 179.571 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.16 -31.84 65.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.234 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -66.21 -37.87 86.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.223 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.921 ' CG1' HD23 ' A' ' 24' ' ' LEU . 9.1 p -75.39 -27.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.611 HG23 ' HE1' ' A' ' 43' ' ' PHE . 35.7 mm -58.8 -42.41 85.43 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.999 0.428 . . . . 0.0 110.107 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -45.55 78.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -46.47 89.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.813 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 3.0 t-20 -75.22 -31.32 60.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.732 ' HD2' HD11 ' A' ' 40' ' ' LEU . 13.7 tptt -58.23 -30.41 66.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -106.26 -6.56 18.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.322 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -73.11 -69.04 0.44 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.645 0.26 . . . . 0.0 111.231 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.6 -156.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 111.527 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.505 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -118.61 -178.16 3.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.191 179.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -25.03 64.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.86 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -72.84 -48.33 38.6 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.72 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.83 -29.94 40.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.956 0.408 . . . . 0.0 110.535 179.7 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.804 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.9 tt -58.34 -34.59 70.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.022 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -36.51 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.862 HG13 ' HA ' ' A' ' 8' ' ' LYS . 43.3 t -76.97 -30.98 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.361 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.611 ' HE1' HG23 ' A' ' 28' ' ' ILE . 27.7 t80 -75.85 -48.04 23.1 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.136 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -57.98 -47.51 82.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 89.6 p -59.99 -35.43 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.619 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -67.63 -42.11 82.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.17 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.27 -34.16 42.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.71 -50.77 69.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.25 -44.9 94.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 39.3 tpt85 -60.0 -40.78 90.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.656 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.481 HD23 ' CG2' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -73.94 -39.74 63.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.791 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.9 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -59.27 -50.84 72.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.135 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 2.0 pt-20 -65.36 -27.04 68.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.298 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.32 -28.92 68.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.823 0.344 . . . . 0.0 110.926 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.526 HG21 HG12 ' A' ' 71' ' ' ILE . 59.3 m -82.82 -42.76 17.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.683 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.443 ' HB3' ' CB ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -98.94 5.87 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.388 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 71.8 103.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.941 0.401 . . . . 0.0 111.675 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 1.6 mmpt? 42.37 40.4 1.83 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.497 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.582 ' O ' HD11 ' A' ' 63' ' ' ILE . 1.7 tm? -112.57 121.06 43.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.03 0.443 . . . . 0.0 110.96 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.805 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.45 157.64 40.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.773 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 65.18 -62.87 0.2 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 60' ' ' TYR . 16.4 mttt -53.53 -11.64 0.37 Allowed 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.9 HG12 ' HB1' ' A' ' 52' ' ' ALA . 4.9 mp -60.86 116.88 20.64 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.603 0.24 . . . . 0.0 110.826 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.777 ' HG2' HG23 ' A' ' 67' ' ' VAL . 80.1 Cg_endo -78.19 -167.34 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.551 2.167 . . . . 0.0 112.372 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 -39.87 22.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 95.0 p -59.32 -46.27 89.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.777 HG23 ' HG2' ' A' ' 64' ' ' PRO . 38.8 t -67.83 -43.7 85.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.955 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.596 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -62.77 -33.6 75.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -43.29 98.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.757 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -70.25 -39.7 74.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.811 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.587 HD11 HG12 ' A' ' 67' ' ' VAL . 20.0 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.015 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.846 0.355 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.888 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -63.34 -29.92 71.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.085 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -29.38 42.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.1 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.79 -50.44 72.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.015 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.564 ' HB2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -76.49 -44.53 34.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.763 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 59.2 tp -55.42 -36.87 66.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.048 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -45.86 67.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.064 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -67.7 -30.99 70.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -45.66 92.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.64 -13.96 61.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.391 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.62 -44.0 69.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.49 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 141.19 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.861 0.362 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -79.89 -36.66 36.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -105.02 147.22 28.06 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 120.838 0.352 . . . . 0.0 110.686 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 40.4 mm -74.43 -45.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.276 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -54.07 -51.0 65.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.949 0.404 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.71 -31.78 58.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.871 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.899 ' O ' HG12 ' A' ' 27' ' ' VAL . 3.4 tm? -83.62 -38.19 21.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.798 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -33.56 68.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.055 0.455 . . . . 0.0 110.384 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -64.46 -35.01 79.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.333 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.899 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.8 p -79.02 -24.67 12.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.931 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 24' ' ' LEU . 25.8 mt -62.07 -38.93 82.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 121.003 0.43 . . . . 0.0 110.439 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -74.72 -43.4 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.147 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -70.41 -36.11 73.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.351 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB3' ' CE2' ' A' ' 43' ' ' PHE . 26.2 t-20 -78.28 -41.61 33.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.624 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.497 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.65 -31.91 68.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 110.895 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.439 ' CD2' ' HE2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -92.23 -15.48 27.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -73.57 -71.68 0.3 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.288 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.979 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -62.08 -160.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.078 0.466 . . . . 0.0 111.792 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 t -119.16 -178.19 3.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -59.8 -25.23 64.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.541 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -73.71 -47.49 39.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.795 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.979 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -79.04 -35.45 42.6 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 120.986 0.422 . . . . 0.0 110.14 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.616 ' HA ' HD11 ' A' ' 35' ' ' LEU . 5.6 tt -59.64 -31.16 69.26 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.996 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.03 -36.0 67.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.888 HG13 ' HA ' ' A' ' 8' ' ' LYS . 91.7 t -76.92 -30.76 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.924 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.461 ' CE2' ' HB3' ' A' ' 31' ' ' ASN . 5.9 t80 -74.27 -48.0 31.43 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.4 ' HB2' HD23 ' A' ' 40' ' ' LEU . 2.6 t80 -60.12 -47.99 83.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.137 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -37.02 79.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.988 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.763 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -70.58 -33.82 71.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.53 -37.2 71.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.151 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -45.43 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -58.23 -47.41 83.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.923 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -37.27 83.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.739 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -30.62 62.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.729 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.915 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.78 -51.17 68.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.489 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -30.91 70.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.81 -40.66 89.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.979 0.418 . . . . 0.0 110.483 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.5 HG21 HG12 ' A' ' 71' ' ' ILE . 86.7 m -82.55 -31.51 29.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.59 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.49 ' HG2' HD12 ' A' ' 59' ' ' LEU . 1.3 tpp -95.59 20.91 8.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.074 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.24 -68.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.947 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -159.04 39.43 0.22 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.057 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.0 tm? -119.76 117.85 29.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 111.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.461 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -135.22 161.44 35.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.567 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.9 t70 87.05 -42.41 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.032 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 17.46 13.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.08 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.915 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.5 mp -61.84 110.58 3.33 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.884 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.14 -177.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.391 2.061 . . . . 0.0 112.127 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 95.2 p -89.81 -30.68 17.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.912 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 t -73.57 -42.81 61.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.717 HG12 HD11 ' A' ' 71' ' ' ILE . 24.5 t -57.22 -58.54 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.273 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.461 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.79 -34.14 69.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.803 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -40.24 89.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -75.61 -42.92 50.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.717 HD11 HG12 ' A' ' 67' ' ' VAL . 10.3 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.757 0.313 . . . . 0.0 110.774 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HA ' HG13 ' A' ' 42' ' ' VAL . 17.0 mttp -64.65 -28.95 69.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.1 t -79.33 -35.49 40.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.061 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.55 -50.31 73.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.949 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.687 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.6 m-85 -76.31 -44.82 35.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.706 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.745 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 12.4 tp -55.43 -40.56 71.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -39.13 69.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.006 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -31.55 62.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.624 HD22 ' HG3' ' A' ' 50' ' ' ARG . 0.3 OUTLIER -60.57 -45.71 92.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.61 60.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.174 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -54.07 -28.81 41.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 m -58.95 159.92 6.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.32 -30.19 11.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.128 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 23' ' ' THR . 13.0 t -126.34 146.78 49.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 111.134 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.604 HG13 HD21 ' A' ' 54' ' ' LEU . 47.5 mm -74.69 -32.91 30.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.134 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.98 -51.02 65.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.364 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.594 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -61.69 -41.77 98.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.893 0.377 . . . . 0.0 110.238 179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.939 HD22 HD11 ' A' ' 28' ' ' ILE . 1.4 mt -59.75 -36.9 77.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.26 70.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.656 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -78.64 -23.15 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.22 0.534 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.72 HG23 ' HA ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -93.23 -23.01 5.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.256 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.939 HD11 HD22 ' A' ' 24' ' ' LEU . 1.8 mm -63.66 -48.19 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 8.3 mt-10 -75.25 -33.37 61.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.03 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -76.48 -47.69 22.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.861 0.362 . . . . 0.0 111.419 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 18.4 t-20 -70.5 -34.81 72.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.29 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -65.63 -36.63 84.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.39 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -1.12 57.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -86.62 -69.87 0.65 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.937 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.71 -157.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.112 0.482 . . . . 0.0 111.558 -179.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -118.87 -178.2 3.5 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.214 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -60.73 -25.36 66.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.528 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -47.66 39.05 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.794 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.937 ' CG ' HD12 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -78.89 -32.81 45.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.111 0.482 . . . . 0.0 110.06 179.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.8 tt -59.6 -34.82 73.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.056 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -35.39 66.35 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.74 HG13 ' HA ' ' A' ' 8' ' ' LYS . 25.7 t -76.87 -30.52 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.369 178.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.402 ' CG ' ' OD1' ' A' ' 31' ' ' ASN . 12.1 t80 -75.8 -48.0 23.46 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -60.13 -47.52 85.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.013 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -58.7 -46.61 86.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.022 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.745 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -71.6 -29.89 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.182 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.36 -39.93 37.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.305 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -50.7 69.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -61.2 -47.11 87.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.791 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.624 ' HG3' HD22 ' A' ' 15' ' ' LEU . 10.4 mmp_? -60.89 -39.77 90.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.661 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.18 -30.82 62.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.904 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -66.09 -51.19 60.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.346 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -61.96 -34.04 75.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.934 0.397 . . . . 0.0 110.591 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.604 HD21 HG13 ' A' ' 21' ' ' ILE . 1.3 tp -60.93 -42.17 97.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 m -82.6 -27.0 31.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.571 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.892 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.3 tpp -99.07 13.32 33.26 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 63.77 75.89 0.37 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.938 0.399 . . . . 0.0 111.376 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 51.07 31.33 6.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.133 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.892 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.3 tm? -119.75 117.95 29.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.012 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.3 p90 -134.73 161.09 36.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.0 t0 91.12 -24.7 0.07 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -118.68 25.32 10.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.785 0.326 . . . . 0.0 110.713 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.904 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.3 mp -67.59 110.96 6.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.107 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.432 ' HD2' ' HE1' ' A' ' 56' ' ' MET . 33.1 Cg_exo -59.65 -156.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.368 2.045 . . . . 0.0 111.998 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.9 m -102.42 -46.19 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 m -57.68 -44.07 85.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.344 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.64 HG11 ' SD ' ' A' ' 56' ' ' MET . 21.9 t -55.92 -60.45 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.408 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . 0.456 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.55 -30.73 65.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.628 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -72.06 -28.38 63.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.22 -50.29 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 ' O ' ' A' ' 71' ' ' ILE . 17.9 tt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.111 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.89 0.376 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -87.92 -31.58 19.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.968 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.5 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 1.0 OUTLIER -138.82 149.05 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.863 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 13.5 mttm -46.3 -57.86 7.66 Favored Pre-proline 0 N--CA 1.462 0.167 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.751 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.693 ' C ' HD12 ' A' ' 6' ' ' LEU . 35.5 Cg_endo -63.97 -1.35 3.44 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.69 2.26 . . . . 0.0 112.626 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.693 HD12 ' C ' ' A' ' 5' ' ' PRO . 2.1 mp 76.2 -167.85 0.07 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.859 0.361 . . . . 0.0 110.915 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.23 163.34 12.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.805 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.593 ' HA ' HG13 ' A' ' 42' ' ' VAL . 14.5 mttt -54.05 -27.19 30.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.037 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.2 t -78.19 -35.05 49.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.951 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.404 ' CB ' ' HB3' ' A' ' 6' ' ' LEU . 1.5 m-20 -59.84 -50.41 73.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.841 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.738 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.3 m-85 -74.45 -43.73 54.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 110.406 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.528 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 58.0 tp -56.06 -43.7 78.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.812 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.68 93.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.713 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 -24.39 58.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.085 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 24' ' ' LEU . 1.2 mt -66.72 -45.79 77.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.142 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -68.12 -17.95 64.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.243 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -56.26 -22.45 30.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.245 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.8 p -50.74 176.04 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.485 ' HG3' HG22 ' A' ' 20' ' ' THR . 8.2 pt20 -102.4 -34.05 9.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.988 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.487 HG23 ' H ' ' A' ' 23' ' ' THR . 4.4 t -153.03 164.6 37.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.767 HG13 HD21 ' A' ' 54' ' ' LEU . 43.7 mm -74.5 -41.58 49.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.425 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.23 -48.24 71.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.173 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.487 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -78.08 -40.88 37.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.22 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.952 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.4 tm? -60.33 -38.04 82.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -58.14 -39.12 77.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.073 0.463 . . . . 0.0 110.528 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -59.06 -37.13 76.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.87 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.952 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.4 p -74.26 -26.44 20.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.645 HG23 ' HE1' ' A' ' 43' ' ' PHE . 23.4 mt -60.42 -38.72 78.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.108 0.48 . . . . 0.0 110.234 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -70.53 -46.2 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.693 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -47.54 73.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.449 ' O ' HD22 ' A' ' 35' ' ' LEU . 1.8 t-20 -62.12 -34.11 75.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.439 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.2 -41.29 88.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -90.9 -21.79 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -59.63 -72.62 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.132 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.3 -156.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.158 0.504 . . . . 0.0 111.421 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' HD23 ' A' ' 35' ' ' LEU . 1.2 m -118.66 -178.21 3.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.242 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.91 -25.22 64.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -73.19 -48.06 38.39 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.767 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.6 OUTLIER -79.58 -29.72 41.32 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.242 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.821 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.5 tt -61.35 -36.22 79.59 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.028 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.86 -37.41 68.73 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.738 HG12 ' HB2' ' A' ' 11' ' ' TYR . 12.5 t -77.04 -30.69 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.581 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.645 ' HE1' HG23 ' A' ' 28' ' ' ILE . 25.2 t80 -75.89 -37.98 58.27 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.829 0.347 . . . . 0.0 111.249 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.81 -48.11 48.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 96.8 p -62.11 -33.11 73.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -76.21 -37.72 57.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.173 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.94 -28.23 69.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.219 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -75.03 -46.27 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.052 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -42.25 71.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 109.84 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.63 -48.11 73.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.329 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.876 HD21 HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -57.93 -37.03 73.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.919 179.314 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.961 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -61.1 -51.1 70.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.424 ' HB3' ' HB3' ' A' ' 60' ' ' TYR . 7.7 pt-20 -64.4 -29.6 70.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.624 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.767 HD21 HG13 ' A' ' 21' ' ' ILE . 1.7 mp -59.91 -35.29 74.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.917 0.389 . . . . 0.0 110.25 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.817 ' OG1' HD13 ' A' ' 71' ' ' ILE . 74.4 m -82.11 -34.81 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.475 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.649 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.4 tpp -96.52 20.08 11.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 1.4 m-20 77.45 -72.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.173 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER -151.23 34.63 0.58 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.666 0.269 . . . . 0.0 111.211 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.625 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.4 tm? -117.22 117.99 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.88 0.371 . . . . 0.0 111.47 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.484 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.1 p90 -134.93 161.13 36.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.674 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 10.3 t0 88.1 -25.27 0.09 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.23 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.12 19.5 14.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.907 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.961 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.2 mp -63.39 119.42 53.11 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.786 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.788 ' HG2' HG23 ' A' ' 67' ' ' VAL . 68.8 Cg_endo -73.88 -167.79 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.448 2.099 . . . . 0.0 112.352 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 89.0 p -88.72 -26.45 21.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.1 m -71.27 -46.36 61.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.098 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.788 HG23 ' HG2' ' A' ' 64' ' ' PRO . 41.4 t -63.64 -48.64 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.983 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -56.51 -27.75 58.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.977 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.91 -50.16 15.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.264 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.876 HG12 HD21 ' A' ' 51' ' ' LEU . 1.3 tt -94.32 131.3 41.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.891 0.376 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.867 179.885 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.786 0.327 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -123.41 -54.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.416 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 0.3 OUTLIER -133.47 141.14 47.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.807 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 2.6 mtpt -58.54 -57.7 24.6 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.419 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 91.0 Cg_endo -82.44 39.19 0.81 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.912 2.408 . . . . 0.0 112.857 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.648 HD13 ' HB3' ' A' ' 10' ' ' ASP . 3.6 mt 58.67 160.82 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.849 0.357 . . . . 0.0 111.265 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.407 HG23 ' HB2' ' A' ' 3' ' ' GLU . 0.8 OUTLIER -111.11 179.52 4.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.948 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.892 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -59.85 -30.0 68.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.066 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.43 -29.38 41.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.119 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.648 ' HB3' HD13 ' A' ' 6' ' ' LEU . 16.9 m-20 -63.16 -50.33 70.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.084 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.785 ' HB2' HG12 ' A' ' 42' ' ' VAL . 5.2 m-85 -73.83 -43.16 59.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.838 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.765 HD11 ' CD2' ' A' ' 49' ' ' HIS . 1.5 tp -55.35 -41.48 72.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.987 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.411 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.39 -42.49 59.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.078 -179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.04 -39.14 89.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.99 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.536 HD13 ' CB ' ' A' ' 46' ' ' ALA . 0.5 OUTLIER -59.49 -44.7 93.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -74.85 -25.54 59.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.969 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -56.68 -22.46 35.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.288 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.4 173.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.775 0.322 . . . . 0.0 111.145 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -101.38 -38.08 8.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.183 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 23' ' ' THR . 13.3 t -140.85 159.96 41.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.1 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.602 ' CD1' HD11 ' A' ' 54' ' ' LEU . 47.3 mm -74.49 -37.76 44.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.345 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -53.98 -50.94 65.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.642 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -72.96 -30.37 63.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.905 0.383 . . . . 0.0 110.514 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.962 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -70.26 -39.13 75.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.663 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -58.03 -39.31 78.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.102 0.477 . . . . 0.0 110.533 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -35.03 71.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.728 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.962 HG12 ' O ' ' A' ' 24' ' ' LEU . 5.8 p -77.47 -26.41 15.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.093 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.463 HD11 ' CD1' ' A' ' 24' ' ' LEU . 35.9 mt -59.18 -39.01 77.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.977 0.417 . . . . 0.0 110.42 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.54 -43.53 55.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.821 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 mmtp -65.69 -47.6 74.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.454 ' CB ' ' CE2' ' A' ' 43' ' ' PHE . 2.6 m120 -68.38 -31.7 71.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.084 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.72 -36.16 78.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.084 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -98.35 -22.01 16.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER -57.55 -70.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.227 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.777 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.93 -156.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.229 0.538 . . . . 0.0 111.553 -179.75 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.496 ' N ' HD23 ' A' ' 35' ' ' LEU . 6.8 m -118.67 -178.24 3.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.128 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -59.55 -25.01 64.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.88 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -73.15 -48.32 36.51 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.718 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -79.7 -30.31 40.98 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.412 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.767 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.2 tt -57.99 -35.03 70.63 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.834 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -30.88 62.14 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.892 HG13 ' HA ' ' A' ' 8' ' ' LYS . 47.0 t -76.78 -33.4 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.23 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.454 ' CE2' ' CB ' ' A' ' 31' ' ' ASN . 9.9 t80 -75.87 -43.25 46.46 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.955 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.32 -42.29 98.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.831 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 46.5 p -58.38 -46.0 87.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.813 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.536 ' CB ' HD13 ' A' ' 15' ' ' LEU . . . -59.75 -29.69 68.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.998 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.09 -47.19 85.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.034 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.58 -48.67 76.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.765 ' CD2' HD11 ' A' ' 12' ' ' LEU . 28.9 t60 -60.02 -45.38 92.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -64.75 -48.13 75.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.661 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -30.67 69.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.696 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.526 ' HB1' ' HB3' ' A' ' 59' ' ' LEU . . . -61.46 -51.58 68.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.315 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.533 ' N ' ' HB2' ' A' ' 59' ' ' LEU . 2.1 tm-20 -64.4 -26.88 68.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.66 -179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.602 HD11 ' CD1' ' A' ' 21' ' ' ILE . 5.0 mt -78.36 -36.58 45.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.956 HG21 HG22 ' A' ' 71' ' ' ILE . 9.8 m -82.97 -43.4 16.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.894 ' HB3' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -112.61 3.49 16.71 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.431 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 53' ' ' GLU . 2.1 t30 63.88 126.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.815 0.34 . . . . 0.0 110.581 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 0.4 OUTLIER 49.47 86.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.02 0.438 . . . . 0.0 110.805 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.894 HD21 ' HB3' ' A' ' 56' ' ' MET . 4.1 mm? -119.79 148.62 43.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.666 -179.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.546 ' O ' ' CD1' ' A' ' 63' ' ' ILE . 31.1 m-85 -83.07 161.08 21.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.913 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.6 p30 -61.56 -17.07 53.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.446 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.71 78.43 1.85 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.806 0.336 . . . . 0.0 111.572 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.73 ' CG1' HD12 ' A' ' 59' ' ' LEU . 1.3 mp -68.41 136.05 90.96 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.651 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.27 -157.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.473 2.115 . . . . 0.0 112.208 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 t -99.44 -34.11 10.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.2 m -59.99 -46.18 90.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.973 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.56 ' HB ' HG23 ' A' ' 63' ' ' ILE . 21.7 t -61.37 -45.55 98.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.042 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.697 ' CE3' HG21 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.8 -23.63 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.148 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -28.59 62.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.985 0.421 . . . . 0.0 110.034 179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -76.39 -50.32 14.5 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.805 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.956 HG22 HG21 ' A' ' 55' ' ' THR . 7.4 pt -42.58 125.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.762 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.857 -179.974 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.844 0.354 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 m -103.3 99.47 9.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.874 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -136.29 -176.6 4.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.903 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 0.7 OUTLIER -52.79 -61.61 4.48 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.68 ' C ' HD22 ' A' ' 6' ' ' LEU . 25.4 Cg_endo -62.1 -166.8 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.401 2.067 . . . . 0.0 112.131 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.68 HD22 ' C ' ' A' ' 5' ' ' PRO . 2.8 mm? -117.18 119.58 35.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -86.54 179.51 6.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.968 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.907 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.8 -34.5 71.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -79.41 -30.04 42.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.055 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.582 ' HB3' HD12 ' A' ' 6' ' ' LEU . 4.2 m-20 -61.92 -50.35 72.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.608 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.8 m-30 -68.18 -51.95 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' HB1' ' A' ' 46' ' ' ALA . 1.2 tt -55.37 -45.04 76.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.047 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -45.32 71.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.919 0.39 . . . . 0.0 110.84 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -29.52 70.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.905 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.555 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -63.15 -45.96 89.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.053 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 ttp180 -67.86 -16.87 64.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.274 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -53.95 -24.66 17.22 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.43 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.74 168.76 4.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.876 0.369 . . . . 0.0 111.105 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -41.76 6.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.951 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.605 HG23 ' H ' ' A' ' 23' ' ' THR . 12.8 t -129.16 150.72 50.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.783 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' NH2' ' A' ' 50' ' ' ARG . 39.0 mm -67.56 -39.61 82.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.767 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.99 -51.03 65.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.665 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.605 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -74.61 -29.42 61.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.436 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.737 HD23 ' O ' ' A' ' 24' ' ' LEU . 3.0 tt -69.76 -38.66 76.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.587 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.48 -30.15 64.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.041 0.448 . . . . 0.0 110.456 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -60.26 -33.09 71.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -77.06 -31.36 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.079 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.402 ' CD1' ' CD2' ' A' ' 24' ' ' LEU . 1.7 mp -59.15 -33.31 50.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 110.194 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 1.0 OUTLIER -74.78 -49.0 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.949 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -33.08 72.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG22 ' A' ' 27' ' ' VAL . 47.1 m-20 -74.3 -42.46 59.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.26 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -59.85 -30.16 68.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.892 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.429 ' N ' ' HG3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -98.72 -5.74 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.409 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -70.16 0.52 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.797 0.332 . . . . 0.0 111.232 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.962 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -68.26 -160.42 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.285 0.564 . . . . 0.0 111.97 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -119.17 -178.03 3.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.164 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.65 -25.29 66.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.378 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -72.36 -47.49 49.17 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.733 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.962 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.9 tp10 -78.79 -29.67 45.05 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.928 0.394 . . . . 0.0 110.201 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HA ' HD11 ' A' ' 35' ' ' LEU . 1.1 tt -57.17 -31.21 65.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.715 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.02 -32.4 63.96 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.907 HG13 ' HA ' ' A' ' 8' ' ' LYS . 72.4 t -76.84 -32.79 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.042 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -75.94 -42.63 48.13 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.868 0.366 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.48 -48.13 68.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.978 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.1 t -58.87 -46.52 87.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.853 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.55 ' HB1' ' HG ' ' A' ' 12' ' ' LEU . . . -71.02 -28.57 64.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.149 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.406 ' O ' HD23 ' A' ' 51' ' ' LEU . . . -61.31 -66.34 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.334 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -54.94 -43.66 73.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.183 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -51.6 67.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.837 0.351 . . . . 0.0 110.459 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.413 ' NH2' ' CD1' ' A' ' 21' ' ' ILE . 0.7 OUTLIER -61.24 -40.75 95.21 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.119 0.485 . . . . 0.0 109.955 179.161 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -66.71 -34.8 78.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.159 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.937 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -65.34 -51.04 63.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.15 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.431 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 8.7 pt-20 -56.93 -41.89 79.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.859 0.361 . . . . 0.0 110.465 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.12 -29.04 65.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.205 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.412 HG21 HG12 ' A' ' 67' ' ' VAL . 2.7 m -82.34 -36.01 27.29 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.092 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.763 ' SD ' HG11 ' A' ' 67' ' ' VAL . 11.4 mmm -93.12 17.96 10.09 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 m120 64.38 62.71 0.8 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.037 0.446 . . . . 0.0 110.962 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 mmpt? 64.71 27.23 13.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.977 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.802 HD22 ' N ' ' A' ' 60' ' ' TYR . 1.0 OUTLIER -119.96 121.51 39.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.94 0.4 . . . . 0.0 111.372 179.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.802 ' N ' HD22 ' A' ' 59' ' ' LEU . 4.4 p90 -126.35 161.47 27.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.563 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 1.1 t70 87.7 -7.75 0.59 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.027 -179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.649 ' HB2' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -128.6 13.62 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.704 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.937 HG12 ' HB1' ' A' ' 52' ' ' ALA . 1.8 mp -65.2 118.2 47.44 Favored Pre-proline 0 C--N 1.333 -0.127 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.903 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.692 ' HG2' HG23 ' A' ' 67' ' ' VAL . 61.9 Cg_endo -73.25 -168.17 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.407 2.071 . . . . 0.0 112.22 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -92.34 -28.61 16.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.6 m -68.39 -46.2 70.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.056 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.763 HG11 ' SD ' ' A' ' 56' ' ' MET . 23.3 t -69.19 -49.43 61.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.105 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.71 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -57.65 -40.58 79.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 tttm -63.03 -30.89 71.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.779 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -70.9 -50.18 37.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.898 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.446 HG23 ' CE3' ' A' ' 68' ' ' TRP . 2.4 tt -91.66 125.16 44.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.064 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.784 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.744 ' O ' HD23 ' A' ' 6' ' ' LEU . 4.6 mtt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.655 0.264 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.4 p -66.55 109.99 3.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.988 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -166.25 -175.16 3.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.796 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 18.3 mtmt -52.93 -62.38 3.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.819 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 98.1 Cg_endo -78.56 57.42 6.31 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.543 2.162 . . . . 0.0 112.176 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.744 HD23 ' O ' ' A' ' 1' ' ' MET . 2.4 tm? -105.08 -79.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.988 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.606 HG23 HD13 ' A' ' 6' ' ' LEU . 9.2 p -147.72 170.74 16.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.832 0.348 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HA ' HG13 ' A' ' 42' ' ' VAL . 28.1 mttt -59.14 -38.88 80.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.742 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -42.79 85.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.003 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.1 -50.37 69.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.007 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.417 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -76.6 -44.26 35.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.971 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.692 HD23 ' O ' ' A' ' 46' ' ' ALA . 2.9 tm? -55.38 -47.32 76.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.293 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -69.72 -31.17 69.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.777 0.323 . . . . 0.0 110.935 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -77.9 -29.69 50.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.023 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.967 HD23 HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -66.28 -45.81 79.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.077 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -18.03 63.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -23.65 19.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.26 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.48 -173.1 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -102.29 -39.93 6.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.183 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 23' ' ' THR . 13.6 t -139.2 150.64 45.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.101 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 21' ' ' ILE . 3.3 mp -74.63 -32.49 29.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.864 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -55.87 -50.96 69.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.641 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -63.47 -45.46 90.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.494 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.967 HD13 HD23 ' A' ' 15' ' ' LEU . 1.9 mt -56.04 -31.49 63.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -39.85 79.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.091 0.472 . . . . 0.0 109.823 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -48.18 77.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.23 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.796 ' CG1' HD23 ' A' ' 24' ' ' LEU . 3.8 p -71.75 -23.85 22.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.5 HD12 ' CZ ' ' A' ' 43' ' ' PHE . 1.1 tp -59.16 -38.48 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.337 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -43.51 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.691 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.5 tpmp? -64.64 -47.45 78.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.857 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 1.1 t-20 -59.01 -34.61 72.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.903 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.41 ' O ' HD12 ' A' ' 40' ' ' LEU . 12.3 mtpt -58.63 -47.22 85.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.656 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -88.54 -7.09 57.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.123 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -74.55 -67.62 0.61 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.128 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.782 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.23 -155.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.193 0.521 . . . . 0.0 111.388 -179.804 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 35' ' ' LEU . 22.9 t -118.56 -178.25 3.49 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.168 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.0 -25.08 64.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.837 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -72.76 -48.26 39.88 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.734 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.4 OUTLIER -79.79 -29.83 40.47 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.513 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.782 ' HB2' HD21 ' A' ' 35' ' ' LEU . 8.2 tt -58.93 -36.72 75.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.874 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.52 66.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.549 HG13 ' HA ' ' A' ' 8' ' ' LYS . 8.0 t -76.95 -30.69 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.295 178.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.5 ' CZ ' HD12 ' A' ' 28' ' ' ILE . 7.3 t80 -75.81 -42.37 50.13 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.086 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -65.96 -48.01 72.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.944 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.5 p -67.79 -46.26 72.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.996 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.692 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -65.86 -34.93 79.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.14 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.63 -24.47 58.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.407 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.403 ' OD2' ' CZ2' ' A' ' 68' ' ' TRP . 0.1 OUTLIER -73.64 -50.82 19.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.055 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -55.48 -51.8 65.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.069 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.624 ' CD ' HD22 ' A' ' 15' ' ' LEU . 5.0 ptm85 -54.75 -40.73 69.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.208 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -47.88 35.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.872 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.704 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.62 -49.38 76.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.413 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -64.73 -29.44 70.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.171 -179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 50' ' ' ARG . 0.2 OUTLIER -65.8 -28.91 69.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.129 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 59.9 m -80.11 -39.01 30.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.491 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.601 ' CE ' HG21 ' A' ' 67' ' ' VAL . 3.7 tpp -99.67 4.67 45.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.783 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.8 t30 77.27 91.79 0.07 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.971 0.415 . . . . 0.0 111.79 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.6 OUTLIER 40.34 48.97 2.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.468 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.575 ' HB3' ' HB3' ' A' ' 56' ' ' MET . 2.5 tm? -119.96 118.07 29.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.695 0.284 . . . . 0.0 111.142 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.553 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 0.1 OUTLIER -132.79 160.48 36.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 110.979 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.0 t0 74.92 4.95 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.888 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.25 7.44 1.02 Allowed 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.704 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.7 mp -63.34 110.61 3.8 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.43 -178.44 0.36 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.519 2.146 . . . . 0.0 112.245 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.82 -46.45 14.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.73 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.44 -46.2 69.76 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.067 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.601 HG21 ' CE ' ' A' ' 56' ' ' MET . 21.9 t -59.65 -55.12 25.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.469 ' CE3' HG23 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.86 -44.42 94.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.588 179.667 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -32.98 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.003 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -70.06 -50.22 43.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.951 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 71' ' ' ILE . 14.2 tt -93.3 119.04 40.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.207 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.887 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.921 0.391 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -67.39 81.08 0.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -178.76 -98.93 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.553 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.846 ' HB2' HG23 ' A' ' 7' ' ' THR . 0.1 OUTLIER 52.85 174.98 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.179 0 CA-C-O 120.607 0.241 . . . . 0.0 110.926 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.462 ' CD ' ' HB3' ' A' ' 4' ' ' LYS . 24.6 Cg_exo -63.19 72.62 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.511 2.141 . . . . 0.0 112.183 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.471 ' N ' HD22 ' A' ' 6' ' ' LEU . 3.6 mm? 61.45 83.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.14 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.846 HG23 ' HB2' ' A' ' 4' ' ' LYS . 1.1 p -84.63 179.63 7.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.872 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.851 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -51.75 -32.42 30.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.174 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.31 -35.89 40.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.03 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.1 -50.36 74.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.14 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.489 ' HB2' HG12 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -69.69 -52.03 29.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.825 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.597 HD23 ' O ' ' A' ' 12' ' ' LEU . 5.2 tt -56.0 -40.59 73.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -42.92 84.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.5 mtt180 -76.28 -27.81 56.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.955 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -59.36 -42.73 92.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.906 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -69.19 -22.23 63.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -56.06 -22.65 28.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.287 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.818 ' SG ' HD12 ' A' ' 24' ' ' LEU . 31.0 p -49.63 172.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.28 -35.22 8.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.611 HG23 ' H ' ' A' ' 23' ' ' THR . 14.9 t -150.01 159.7 44.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.88 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 54' ' ' LEU . 41.1 mm -74.44 -39.34 48.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.596 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -53.9 -50.94 65.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.647 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.611 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -70.68 -29.02 65.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.661 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.884 ' O ' HG12 ' A' ' 27' ' ' VAL . 5.2 tt -74.66 -36.07 62.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -57.48 -32.47 67.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.052 0.453 . . . . 0.0 110.195 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -64.5 -33.8 76.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.197 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.884 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.1 p -80.98 -26.8 10.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.204 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 24' ' ' LEU . 29.5 mt -59.01 -40.27 80.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.978 0.418 . . . . 0.0 110.313 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -74.73 -41.73 59.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.838 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -68.61 -47.68 66.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.243 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.464 ' HB2' ' CE2' ' A' ' 43' ' ' PHE . 2.3 m120 -66.08 -31.65 72.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.61 -48.1 82.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.139 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.16 -2.38 58.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.783 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 31' ' ' ASN . 3.2 mt-10 -79.36 -77.86 0.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.759 0.314 . . . . 0.0 110.952 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.969 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.78 -157.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.204 0.526 . . . . 0.0 111.577 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.2 m -118.76 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.306 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -60.69 -25.4 66.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.536 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -73.67 -47.52 39.1 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.816 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.969 ' CG ' HD12 ' A' ' 35' ' ' LEU . 2.7 tp10 -78.86 -34.99 44.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.993 0.425 . . . . 0.0 110.15 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.71 ' HB2' HD21 ' A' ' 35' ' ' LEU . 7.8 tt -57.99 -34.73 70.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.332 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -34.53 65.27 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 8' ' ' LYS . 65.0 t -76.96 -33.29 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.337 178.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 31' ' ' ASN . 8.9 t80 -76.1 -48.07 22.12 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.436 -179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.65 -48.3 81.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.5 p -67.96 -37.17 81.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.652 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.18 -40.16 46.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.789 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.28 -34.71 59.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.855 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.45 ' HB3' ' CH2' ' A' ' 68' ' ' TRP . 10.6 m-20 -72.0 -50.69 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.56 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.85 -45.14 74.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.129 0.49 . . . . 0.0 110.019 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.404 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -64.16 -47.86 78.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.681 0.753 . . . . 0.0 109.588 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.895 ' O ' HD22 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -60.89 -33.8 73.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.662 -1.153 . . . . 0.0 110.341 179.714 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.957 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -63.83 -51.32 65.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.099 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.419 ' O ' ' N ' ' A' ' 58' ' ' LYS . 5.0 pt-20 -57.34 -41.89 80.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.738 0.304 . . . . 0.0 110.767 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.434 HD11 HD11 ' A' ' 21' ' ' ILE . 2.8 mt -58.69 -31.78 68.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.921 0.391 . . . . 0.0 110.623 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.62 -33.19 27.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.951 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.804 ' HG2' HD12 ' A' ' 59' ' ' LEU . 9.9 tpp -95.99 15.93 19.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.496 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 65.87 68.86 0.46 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.045 0.45 . . . . 0.0 111.168 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 55.91 28.79 13.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.673 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.804 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.2 tm? -119.83 118.57 31.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.893 0.377 . . . . 0.0 111.485 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -128.57 161.23 30.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.666 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.499 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 13.8 t0 89.72 -12.41 0.35 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.974 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.692 ' HB3' HD11 ' A' ' 59' ' ' LEU . 3.8 tmmt? -131.24 20.48 4.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.734 0.302 . . . . 0.0 110.801 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.957 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.9 mp -62.21 110.69 3.53 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.034 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.485 ' HB2' HG23 ' A' ' 67' ' ' VAL . 52.0 Cg_exo -55.23 166.02 2.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.47 2.114 . . . . 0.0 112.263 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.8 m -74.92 -40.26 60.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.931 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -43.74 98.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.929 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.72 HG11 ' CE ' ' A' ' 56' ' ' MET . 14.5 t -65.71 -51.29 63.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.729 ' CH2' HD12 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -57.67 -42.33 83.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.895 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -60.61 -30.57 69.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.731 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -75.96 -50.29 15.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.807 ' CD1' HD21 ' A' ' 51' ' ' LEU . 1.5 tt -92.59 124.38 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.183 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.4 ttt85 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.883 -179.977 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.86 0.362 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.92 15.99 5.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 64.39 -102.88 0.1 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.616 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.489 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 2.7 mttm 54.89 173.25 0.04 OUTLIER Pre-proline 0 CA--C 1.529 0.142 0 O-C-N 122.354 -0.216 . . . . 0.0 110.519 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.489 ' HD2' ' CB ' ' A' ' 4' ' ' LYS . 23.1 Cg_endo -61.89 75.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.083 1.855 . . . . 0.0 111.835 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.613 ' N ' HD22 ' A' ' 6' ' ' LEU . 2.6 mm? 63.89 88.92 0.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.029 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.414 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -83.84 178.79 7.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.868 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.9 OUTLIER -51.69 -37.54 51.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 -179.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.66 -29.23 40.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.414 ' HB2' ' N ' ' A' ' 7' ' ' THR . 3.3 m-20 -55.07 -50.79 68.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.654 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.707 ' HB2' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -76.75 -36.91 56.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.683 0.278 . . . . 0.0 111.065 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 8' ' ' LYS . 13.7 mt -55.14 -47.5 75.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.131 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 34.7 mtm -76.92 -41.8 41.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -60.58 -37.06 80.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.807 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.54 HD22 ' HD2' ' A' ' 50' ' ' ARG . 1.7 tt -64.28 -45.77 86.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.81 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -71.86 -22.61 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.964 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.62 -27.11 57.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.215 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 167.57 0.46 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -96.59 -41.4 8.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.119 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.618 HG23 ' H ' ' A' ' 23' ' ' THR . 9.9 t -131.43 160.81 34.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.408 HG13 HD21 ' A' ' 54' ' ' LEU . 44.6 mm -74.51 -41.15 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.294 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.2 -50.89 66.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.032 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.618 ' H ' HG23 ' A' ' 20' ' ' THR . 0.7 OUTLIER -64.85 -44.52 89.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.009 0.433 . . . . 0.0 110.454 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.935 ' O ' HG12 ' A' ' 27' ' ' VAL . 1.5 tm? -58.38 -38.79 78.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.847 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -57.96 -38.11 75.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.087 0.47 . . . . 0.0 110.549 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -59.06 -38.84 80.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.635 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.935 HG12 ' O ' ' A' ' 24' ' ' LEU . 6.3 p -72.97 -26.01 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.207 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.538 HG23 ' HE1' ' A' ' 43' ' ' PHE . 22.7 mt -61.63 -38.17 79.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.952 0.406 . . . . 0.0 110.481 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 6.0 tt0 -74.14 -36.41 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -36.11 60.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.854 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.567 ' O ' HD22 ' A' ' 35' ' ' LEU . 1.2 m-80 -78.55 -42.56 28.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.325 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HA ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.57 -36.16 73.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.019 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -87.93 -19.87 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -68.42 -78.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.23 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.94 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.38 -158.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.214 0.53 . . . . 0.0 111.559 -179.687 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.91 -178.11 3.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.325 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.35 -25.39 65.8 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.588 179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -74.16 -47.45 35.75 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.894 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.94 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -78.94 -33.92 44.94 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.005 0.431 . . . . 0.0 110.071 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.685 ' HA ' HD11 ' A' ' 35' ' ' LEU . 7.5 tt -58.33 -32.97 68.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.9 -30.57 61.8 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.868 HG13 ' HA ' ' A' ' 8' ' ' LYS . 89.0 t -76.84 -34.43 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.171 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HE1' HG23 ' A' ' 28' ' ' ILE . 13.1 t80 -75.98 -47.96 22.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.965 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.44 -42.61 87.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.027 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 39.8 m -60.01 -42.63 94.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.957 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -74.73 -30.64 61.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.309 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.07 -50.42 19.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.227 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.76 -48.05 80.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.01 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.5 m170 -56.05 -39.48 72.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.993 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.54 ' HD2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -70.52 -39.51 74.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.89 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.28 60.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.778 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.909 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -57.8 -51.18 70.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.245 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.802 ' HA ' HD23 ' A' ' 59' ' ' LEU . 24.6 pt-20 -61.94 -42.12 98.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.047 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.408 HD21 HG13 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -61.95 -28.67 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.9 m -65.17 -42.92 93.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.636 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.865 ' HB3' HD22 ' A' ' 59' ' ' LEU . 32.2 ttm -99.61 -30.76 11.94 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.612 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' MET . 4.5 m-20 156.94 -74.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.244 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -153.0 32.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.5 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.865 HD22 ' HB3' ' A' ' 56' ' ' MET . 0.2 OUTLIER -88.57 139.74 30.17 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.591 -179.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.739 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -135.04 154.18 51.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.832 179.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.79 -62.09 0.2 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -56.96 -5.53 0.25 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.32 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.909 HG12 ' HB1' ' A' ' 52' ' ' ALA . 5.3 mp -60.94 110.26 2.82 Favored Pre-proline 0 C--N 1.33 -0.274 0 C-N-CA 121.167 -0.213 . . . . 0.0 110.712 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -66.65 -158.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.637 2.225 . . . . 0.0 112.067 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -98.2 -25.03 15.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.829 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.466 ' HA ' ' HG2' ' A' ' 69' ' ' LYS . 0.3 OUTLIER -69.86 -46.15 66.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.969 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.86 -40.22 80.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.094 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.679 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -65.63 -39.1 91.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.964 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.466 ' HG2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -66.27 -27.27 67.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.014 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.417 ' N ' ' HG3' ' A' ' 69' ' ' LYS . 12.3 t80 -66.31 -50.22 64.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.6 tt -87.09 144.24 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.865 179.959 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 tpt . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.92 0.39 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.7 m -150.05 -73.44 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.76 ' CB ' HG23 ' A' ' 7' ' ' THR . 1.2 tt0 -147.17 142.25 27.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.81 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -58.31 17.83 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.117 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -77.6 44.8 1.6 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.731 2.288 . . . . 0.0 113.239 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.616 ' N ' HD22 ' A' ' 6' ' ' LEU . 2.4 mm? 59.63 148.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.081 0.467 . . . . 0.0 111.626 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.76 HG23 ' CB ' ' A' ' 3' ' ' GLU . 0.1 OUTLIER -120.63 179.5 4.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.965 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -53.82 -31.71 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.228 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.18 -36.09 55.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.476 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 6.2 m-20 -54.83 -50.32 68.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.383 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.686 ' HB2' HG12 ' A' ' 42' ' ' VAL . 8.1 m-85 -74.84 -38.38 62.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.87 0.367 . . . . 0.0 110.91 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.586 HD13 ' C ' ' A' ' 12' ' ' LEU . 2.3 tm? -55.5 -47.44 76.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.43 ' HE3' ' HB2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.19 -32.64 63.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 0.0 111.08 -179.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 1.4 ttt180 -74.02 -23.91 59.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.923 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.806 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -72.94 -45.74 56.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.938 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -64.01 -17.17 63.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.499 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -54.05 -26.6 27.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.754 0.312 . . . . 0.0 111.278 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.66 165.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.826 0.346 . . . . 0.0 110.967 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -78.03 -40.68 38.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 23' ' ' THR . 14.2 t -149.93 165.74 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.651 HG12 HD21 ' A' ' 54' ' ' LEU . 2.0 mp -74.52 -29.93 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.39 -50.5 67.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.93 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.432 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -75.99 -32.51 59.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.198 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.896 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.68 -36.18 81.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.444 179.622 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 28' ' ' ILE . 3.9 tp10 -57.15 -31.82 65.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.234 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -65.15 -34.95 79.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.114 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.896 HG12 ' O ' ' A' ' 24' ' ' LEU . 8.6 p -79.84 -27.28 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.07 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 24' ' ' LEU . 39.0 mm -58.14 -39.91 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-O 121.113 0.482 . . . . 0.0 110.233 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -74.18 -43.18 58.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.563 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -64.17 -47.59 79.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.101 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 43' ' ' PHE . 0.7 OUTLIER -66.86 -31.66 72.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.031 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -58.55 -40.34 82.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.952 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -98.99 -0.06 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.507 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -78.91 -68.92 0.61 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.693 0.283 . . . . 0.0 111.216 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.786 HD23 ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -72.67 -156.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.217 0.532 . . . . 0.0 111.611 -179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.51 ' N ' HD23 ' A' ' 35' ' ' LEU . 32.6 t -118.71 -178.19 3.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.098 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 p30 -59.65 -25.03 64.37 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -48.41 39.4 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.719 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.73 -29.92 40.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.962 0.41 . . . . 0.0 110.318 179.556 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.765 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.9 tt -57.41 -32.81 67.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.788 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.01 -35.59 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.965 HG13 ' HA ' ' A' ' 8' ' ' LYS . 57.9 t -76.78 -30.83 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.143 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 31' ' ' ASN . 8.9 t80 -75.83 -41.35 52.84 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.087 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.54 -48.18 80.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.5 p -59.95 -35.81 75.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.912 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.49 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -77.23 -29.71 54.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.242 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.23 -52.56 9.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.195 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.74 -44.72 90.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.995 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -58.78 -49.04 79.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.966 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.48 ' HG3' HD22 ' A' ' 15' ' ' LEU . 9.9 mmt180 -61.67 -44.71 96.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -30.71 69.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.896 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.54 -50.98 69.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.222 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -63.98 -30.68 71.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.856 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 HG12 ' A' ' 21' ' ' ILE . 2.3 mp -60.55 -35.59 76.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.688 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -78.74 -36.3 43.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.986 ' HE1' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -96.92 20.87 10.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 78.48 -63.92 0.28 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.859 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -160.5 40.84 0.17 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.077 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.59 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.6 tm? -119.76 117.87 29.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.895 0.379 . . . . 0.0 111.261 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.0 p90 -135.04 161.13 36.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.767 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.482 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 3.1 t0 89.08 -30.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.225 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -112.25 26.56 10.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.765 0.317 . . . . 0.0 110.893 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.986 HG23 ' HE1' ' A' ' 56' ' ' MET . 1.9 mp -72.22 118.24 65.59 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.035 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.781 ' HG2' HG23 ' A' ' 67' ' ' VAL . 74.5 Cg_endo -74.68 -167.61 0.42 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.416 2.077 . . . . 0.0 112.294 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -90.57 -26.63 19.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.067 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 92.0 p -70.17 -46.18 65.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.781 HG23 ' HG2' ' A' ' 64' ' ' PRO . 42.2 t -63.5 -54.96 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.224 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.452 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.53 -34.3 68.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.903 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -68.33 -30.32 69.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.87 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -73.95 -49.78 23.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.558 HD13 ' C ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -91.23 118.86 37.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.953 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 71' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.911 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 mtm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.657 ' HA ' HG21 ' A' ' 7' ' ' THR . 18.8 t -115.08 119.59 36.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.933 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -77.72 179.75 6.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' CB ' ' HD3' ' A' ' 5' ' ' PRO . 0.6 OUTLIER -59.66 -52.45 73.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.851 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD3' ' CB ' ' A' ' 4' ' ' LYS . 38.9 Cg_exo -60.53 -159.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.538 2.159 . . . . 0.0 112.028 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.608 ' N ' HD22 ' A' ' 6' ' ' LEU . 2.7 mm? -97.14 115.3 27.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.79 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.657 HG21 ' HA ' ' A' ' 2' ' ' SER . 72.0 p -83.99 177.76 8.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.046 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.862 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -58.65 -35.17 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.47 -34.64 41.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.05 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.97 -50.5 68.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.174 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.605 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.9 m-85 -76.56 -43.76 37.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.428 . . . . 0.0 110.704 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.619 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.5 tm? -55.93 -47.08 78.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.228 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -31.21 69.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.3 mtt-85 -77.86 -30.35 50.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.809 ' O ' HD11 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -65.87 -45.65 81.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.04 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -64.6 -16.09 62.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.1 ttp85 -54.02 -28.5 38.69 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.777 0.322 . . . . 0.0 111.095 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.65 179.05 0.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.872 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -99.22 -36.05 9.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.97 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 23' ' ' THR . 14.6 t -147.02 157.79 43.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.594 ' N ' HD12 ' A' ' 21' ' ' ILE . 1.8 mp -73.77 -29.51 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.793 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.55 -49.9 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.732 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.614 ' H ' HG23 ' A' ' 20' ' ' THR . 1.0 OUTLIER -76.4 -32.24 58.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.052 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.921 HD23 ' CG1' ' A' ' 27' ' ' VAL . 0.5 OUTLIER -66.18 -35.69 81.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.401 179.571 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.16 -31.84 65.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.234 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -66.21 -37.87 86.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.223 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.921 ' CG1' HD23 ' A' ' 24' ' ' LEU . 9.1 p -75.39 -27.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.611 HG23 ' HE1' ' A' ' 43' ' ' PHE . 35.7 mm -58.8 -42.41 85.43 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.999 0.428 . . . . 0.0 110.107 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -45.55 78.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -46.47 89.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.813 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 43' ' ' PHE . 3.0 t-20 -75.22 -31.32 60.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.732 ' HD2' HD11 ' A' ' 40' ' ' LEU . 13.7 tptt -58.23 -30.41 66.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.719 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -106.26 -6.56 18.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.322 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -73.11 -69.04 0.44 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.645 0.26 . . . . 0.0 111.231 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.6 -156.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 111.527 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.505 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -118.61 -178.16 3.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.191 179.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.9 -25.03 64.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.86 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -72.84 -48.33 38.6 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.72 ' HB2' HD12 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -79.83 -29.94 40.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.956 0.408 . . . . 0.0 110.535 179.7 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.804 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.9 tt -58.34 -34.59 70.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.022 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.75 -36.51 67.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.862 HG13 ' HA ' ' A' ' 8' ' ' LYS . 43.3 t -76.97 -30.98 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.361 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.611 ' HE1' HG23 ' A' ' 28' ' ' ILE . 27.7 t80 -75.85 -48.04 23.1 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.136 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -57.98 -47.51 82.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 89.6 p -59.99 -35.43 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.619 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -67.63 -42.11 82.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.17 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.27 -34.16 42.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.71 -50.77 69.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 m170 -60.25 -44.9 94.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 39.3 tpt85 -60.0 -40.78 90.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.656 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.481 HD23 ' CG2' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -73.94 -39.74 63.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.791 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.9 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -59.27 -50.84 72.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.135 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 2.0 pt-20 -65.36 -27.04 68.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.298 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.32 -28.92 68.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.823 0.344 . . . . 0.0 110.926 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.526 HG21 HG12 ' A' ' 71' ' ' ILE . 59.3 m -82.82 -42.76 17.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.683 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.443 ' HB3' ' CB ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -98.94 5.87 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.388 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 71.8 103.09 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.941 0.401 . . . . 0.0 111.675 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 58' ' ' LYS . 1.6 mmpt? 42.37 40.4 1.83 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.497 179.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.582 ' O ' HD11 ' A' ' 63' ' ' ILE . 1.7 tm? -112.57 121.06 43.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.03 0.443 . . . . 0.0 110.96 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.805 ' HA ' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -128.45 157.64 40.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.773 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 65.18 -62.87 0.2 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 60' ' ' TYR . 16.4 mttt -53.53 -11.64 0.37 Allowed 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.9 HG12 ' HB1' ' A' ' 52' ' ' ALA . 4.9 mp -60.86 116.88 20.64 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.603 0.24 . . . . 0.0 110.826 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.777 ' HG2' HG23 ' A' ' 67' ' ' VAL . 80.1 Cg_endo -78.19 -167.34 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.551 2.167 . . . . 0.0 112.372 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 -39.87 22.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 95.0 p -59.32 -46.27 89.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.777 HG23 ' HG2' ' A' ' 64' ' ' PRO . 38.8 t -67.83 -43.7 85.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.955 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.596 ' CZ2' ' HB2' ' A' ' 52' ' ' ALA . 0.0 OUTLIER -62.77 -33.6 75.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.672 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -43.29 98.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.757 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -70.25 -39.7 74.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.811 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.587 HD11 HG12 ' A' ' 67' ' ' VAL . 20.0 mt -72.02 108.38 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.015 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.833 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.401 ' HA ' HG21 ' A' ' 7' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.822 0.344 . . . . 0.0 111.18 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -164.7 -72.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.865 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -98.95 157.43 16.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 5' ' ' PRO . 8.8 mttp -65.66 -62.15 4.84 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.111 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.571 ' C ' HD22 ' A' ' 6' ' ' LEU . 18.6 Cg_endo -57.98 -77.88 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.601 2.201 . . . . 0.0 112.584 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.571 HD22 ' C ' ' A' ' 5' ' ' PRO . 2.9 mm? -125.18 137.94 54.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.873 0.368 . . . . 0.0 111.069 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.401 HG21 ' HA ' ' A' ' 1' ' ' MET . 2.3 p -93.64 177.61 5.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.888 ' HA ' HG13 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -63.34 -29.92 71.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.085 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -29.38 42.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.1 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.447 ' CG ' HD12 ' A' ' 6' ' ' LEU . 0.9 OUTLIER -61.79 -50.44 72.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.015 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.564 ' HB2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -76.49 -44.53 34.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.763 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 59.2 tp -55.42 -36.87 66.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.048 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.5 -45.86 67.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.064 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -67.7 -30.99 70.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -45.66 92.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.948 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.64 -13.96 61.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.391 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.62 -44.0 69.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.49 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 141.19 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.861 0.362 . . . . 0.0 110.679 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -79.89 -36.66 36.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -105.02 147.22 28.06 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 120.838 0.352 . . . . 0.0 110.686 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 40.4 mm -74.43 -45.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.276 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -54.07 -51.0 65.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.949 0.404 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.71 -31.78 58.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.871 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.899 ' O ' HG12 ' A' ' 27' ' ' VAL . 3.4 tm? -83.62 -38.19 21.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.798 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -33.56 68.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.055 0.455 . . . . 0.0 110.384 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -64.46 -35.01 79.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.333 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.899 HG12 ' O ' ' A' ' 24' ' ' LEU . 9.8 p -79.02 -24.67 12.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.931 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 24' ' ' LEU . 25.8 mt -62.07 -38.93 82.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 121.003 0.43 . . . . 0.0 110.439 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -74.72 -43.4 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.147 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -70.41 -36.11 73.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.351 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB3' ' CE2' ' A' ' 43' ' ' PHE . 26.2 t-20 -78.28 -41.61 33.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.624 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.497 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.65 -31.91 68.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 110.895 -179.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.439 ' CD2' ' HE2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -92.23 -15.48 27.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -73.57 -71.68 0.3 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.288 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.979 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -62.08 -160.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.078 0.466 . . . . 0.0 111.792 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 t -119.16 -178.19 3.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -59.8 -25.23 64.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.541 179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -73.71 -47.49 39.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.795 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.979 ' CG ' HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -79.04 -35.45 42.6 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 120.986 0.422 . . . . 0.0 110.14 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.616 ' HA ' HD11 ' A' ' 35' ' ' LEU . 5.6 tt -59.64 -31.16 69.26 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.996 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.03 -36.0 67.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.888 HG13 ' HA ' ' A' ' 8' ' ' LYS . 91.7 t -76.92 -30.76 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.924 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.461 ' CE2' ' HB3' ' A' ' 31' ' ' ASN . 5.9 t80 -74.27 -48.0 31.43 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.4 ' HB2' HD23 ' A' ' 40' ' ' LEU . 2.6 t80 -60.12 -47.99 83.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.137 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -37.02 79.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.988 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.763 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -70.58 -33.82 71.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.1 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.53 -37.2 71.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.151 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -45.43 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.951 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -58.23 -47.41 83.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.923 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.13 -37.27 83.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.739 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -30.62 62.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.729 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.915 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -62.78 -51.17 68.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.489 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.47 -30.91 70.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.71 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.81 -40.66 89.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.979 0.418 . . . . 0.0 110.483 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.5 HG21 HG12 ' A' ' 71' ' ' ILE . 86.7 m -82.55 -31.51 29.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.59 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.49 ' HG2' HD12 ' A' ' 59' ' ' LEU . 1.3 tpp -95.59 20.91 8.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.074 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 75.24 -68.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.947 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -159.04 39.43 0.22 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.057 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.641 ' C ' HD13 ' A' ' 59' ' ' LEU . 2.0 tm? -119.76 117.85 29.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 111.209 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.461 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.4 p90 -135.22 161.44 35.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.567 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.9 t70 87.05 -42.41 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.032 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 17.46 13.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.08 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.915 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.5 mp -61.84 110.58 3.33 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.884 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.14 -177.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.391 2.061 . . . . 0.0 112.127 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 95.2 p -89.81 -30.68 17.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.912 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.5 t -73.57 -42.81 61.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.717 HG12 HD11 ' A' ' 71' ' ' ILE . 24.5 t -57.22 -58.54 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.273 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.461 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.79 -34.14 69.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.803 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -40.24 89.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -75.61 -42.92 50.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.717 HD11 HG12 ' A' ' 67' ' ' VAL . 10.3 mt -66.85 132.1 32.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mtt-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.159 -0.924 . . . . 0.0 110.907 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.783 0.325 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.503 ' HB2' HG21 ' A' ' 7' ' ' THR . 1.6 m -117.74 -39.27 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.026 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.478 ' H ' HG23 ' A' ' 7' ' ' THR . 0.6 OUTLIER -112.62 146.8 37.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.932 179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.4 ' CB ' ' CD ' ' A' ' 5' ' ' PRO . 1.4 tttp -57.6 -60.52 9.6 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.878 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 4' ' ' LYS . 61.2 Cg_endo -73.1 57.4 3.3 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.517 2.145 . . . . 0.0 112.41 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.42 ' N ' HD22 ' A' ' 6' ' ' LEU . 4.0 mm? 57.48 164.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.206 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.503 HG21 ' HB2' ' A' ' 2' ' ' SER . 0.6 OUTLIER -126.5 169.47 13.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.774 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HA ' HG13 ' A' ' 42' ' ' VAL . 17.0 mttp -64.65 -28.95 69.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.1 t -79.33 -35.49 40.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.061 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.55 -50.31 73.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.949 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.687 ' HB2' HG12 ' A' ' 42' ' ' VAL . 2.6 m-85 -76.31 -44.82 35.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.706 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.745 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 12.4 tp -55.43 -40.56 71.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -39.13 69.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.006 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -31.55 62.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.923 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.624 HD22 ' HG3' ' A' ' 50' ' ' ARG . 0.3 OUTLIER -60.57 -45.71 92.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.61 60.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.174 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 ttt-85 -54.07 -28.81 41.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.121 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.2 m -58.95 159.92 6.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.876 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.32 -30.19 11.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.128 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 23' ' ' THR . 13.0 t -126.34 146.78 49.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 111.134 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.604 HG13 HD21 ' A' ' 54' ' ' LEU . 47.5 mm -74.69 -32.91 30.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.134 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.98 -51.02 65.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.364 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.594 ' H ' HG23 ' A' ' 20' ' ' THR . 0.9 OUTLIER -61.69 -41.77 98.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.893 0.377 . . . . 0.0 110.238 179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.939 HD22 HD11 ' A' ' 28' ' ' ILE . 1.4 mt -59.75 -36.9 77.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.75 -32.26 70.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.656 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -78.64 -23.15 45.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.22 0.534 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.72 HG23 ' HA ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -93.23 -23.01 5.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.256 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.939 HD11 HD22 ' A' ' 24' ' ' LEU . 1.8 mm -63.66 -48.19 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 8.3 mt-10 -75.25 -33.37 61.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.03 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -76.48 -47.69 22.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.861 0.362 . . . . 0.0 111.419 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 18.4 t-20 -70.5 -34.81 72.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.29 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -65.63 -36.63 84.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.39 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.34 -1.12 57.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -86.62 -69.87 0.65 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.937 HD12 ' CG ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.71 -157.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.112 0.482 . . . . 0.0 111.558 -179.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -118.87 -178.2 3.5 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.214 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -60.73 -25.36 66.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.528 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -47.66 39.05 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.794 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.937 ' CG ' HD12 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -78.89 -32.81 45.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.111 0.482 . . . . 0.0 110.06 179.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 35' ' ' LEU . 5.8 tt -59.6 -34.82 73.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.056 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.84 -35.39 66.35 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.74 HG13 ' HA ' ' A' ' 8' ' ' LYS . 25.7 t -76.87 -30.52 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.369 178.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.402 ' CG ' ' OD1' ' A' ' 31' ' ' ASN . 12.1 t80 -75.8 -48.0 23.46 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.99 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -60.13 -47.52 85.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.013 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.5 m -58.7 -46.61 86.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.022 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.745 ' HB1' ' HA ' ' A' ' 12' ' ' LEU . . . -71.6 -29.89 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.182 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.36 -39.93 37.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.305 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -50.7 69.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.095 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -61.2 -47.11 87.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.791 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.624 ' HG3' HD22 ' A' ' 15' ' ' LEU . 10.4 mmp_? -60.89 -39.77 90.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.661 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.18 -30.82 62.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.904 ' HB1' HG12 ' A' ' 63' ' ' ILE . . . -66.09 -51.19 60.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.346 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -61.96 -34.04 75.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.934 0.397 . . . . 0.0 110.591 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.604 HD21 HG13 ' A' ' 21' ' ' ILE . 1.3 tp -60.93 -42.17 97.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 m -82.6 -27.0 31.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.571 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.892 ' HG2' HD12 ' A' ' 59' ' ' LEU . 3.3 tpp -99.07 13.32 33.26 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 63.77 75.89 0.37 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.938 0.399 . . . . 0.0 111.376 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HA ' ' HB2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 51.07 31.33 6.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.133 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.892 HD12 ' HG2' ' A' ' 56' ' ' MET . 3.3 tm? -119.75 117.95 29.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.012 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 61' ' ' ASP . 3.3 p90 -134.73 161.09 36.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' A' ' 60' ' ' TYR . 2.0 t0 91.12 -24.7 0.07 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.173 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -118.68 25.32 10.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.785 0.326 . . . . 0.0 110.713 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.904 HG12 ' HB1' ' A' ' 52' ' ' ALA . 2.3 mp -67.59 110.96 6.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.107 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.432 ' HD2' ' HE1' ' A' ' 56' ' ' MET . 33.1 Cg_exo -59.65 -156.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.368 2.045 . . . . 0.0 111.998 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.9 m -102.42 -46.19 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.851 0.358 . . . . 0.0 111.014 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 m -57.68 -44.07 85.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.344 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.64 HG11 ' SD ' ' A' ' 56' ' ' MET . 21.9 t -55.92 -60.45 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.408 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . 0.456 ' HA ' ' CE3' ' A' ' 68' ' ' TRP . 0.0 OUTLIER -57.55 -30.73 65.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.99 0.424 . . . . 0.0 110.628 179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -72.06 -28.38 63.29 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.22 -50.29 41.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 ' O ' ' A' ' 71' ' ' ILE . 17.9 tt -89.41 107.77 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.111 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.908 -179.966 . . . . . . . . 0 0 . 1 stop_ save_